CodeACE
NameACETYL GROUP
Synonyms
Identifier
FormulaC2 H4 O
Molecular Weight44.053
SMILES
PubChem177
Formal Charge0
Total Atoms7
Total Chiral Atoms0
Total Bonds6
Total Aromatic Bonds0
Networks20
missing image

This ligand is also present in the following 20 networks:

Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7M3G C Ion Calcium Sensing CaS Homo Sapiens - Ca; Ca; Tryptophan; Evocalcet; Etelcalcetide; PO4 - 2.5 2021-06-30 10.1038/s41586-021-03691-0

A 2D representation of the interactions of ACE in 7M3G
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:C482 W:W:?2 11.86 2 Yes Yes 7 0 2 1
R:R:C482 W:W:?3 3.22 2 Yes Yes 7 0 2 1
S:S:E251 S:S:S247 4.31 2 Yes No 4 2 1 2
S:S:S247 W:W:?5 4.79 2 No Yes 2 0 2 2
S:S:D248 S:S:E250 9.09 2 No No 3 2 1 2
S:S:D248 S:S:E251 14.29 2 No Yes 3 4 1 1
S:S:D248 W:W:?1 6.11 2 No Yes 3 0 1 0
S:S:E251 W:W:?1 5.97 2 Yes Yes 4 0 1 0
S:S:E251 W:W:?4 7.4 2 Yes Yes 4 0 1 2
S:S:E251 W:W:?5 10.57 2 Yes Yes 4 0 1 2
W:W:?1 W:W:?2 23.28 2 Yes Yes 0 0 0 1
W:W:?1 W:W:?3 6.32 2 Yes Yes 0 0 0 1
W:W:?2 W:W:?3 20.99 2 Yes Yes 0 0 1 1
W:W:?2 W:W:?6 8.25 2 Yes Yes 0 0 1 2
W:W:?3 W:W:?4 19.04 2 Yes Yes 0 0 1 2
W:W:?3 W:W:?5 3.36 2 Yes Yes 0 0 1 2
W:W:?3 W:W:?6 14.56 2 Yes Yes 0 0 1 2
W:W:?3 W:W:?7 2.85 2 Yes Yes 0 0 1 2
W:W:?4 W:W:?5 14.08 2 Yes Yes 0 0 2 2
W:W:?4 W:W:?6 6.16 2 Yes Yes 0 0 2 2
W:W:?4 W:W:?7 7.84 2 Yes Yes 0 0 2 2
W:W:?5 W:W:?6 14.96 2 Yes Yes 0 0 2 2
W:W:?5 W:W:?7 7.84 2 Yes Yes 0 0 2 2
W:W:?6 W:W:?7 15.68 2 Yes Yes 0 0 2 2
StatisticsValue
Average Number Of Links4.00
Average Number Of Links With An Hub3.00
Average Interaction Strength10.42
Average Nodes In Shell12.00
Average Hubs In Shell9.00
Average Links In Shell24.00
Average Links Mediated by Hubs In Shell23.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)

A 2D representation of the interactions of ACE in 7M3G
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:E251 R:R:S247 4.31 1 Yes Yes 4 2 1 2
R:R:S247 X:X:?5 7.18 1 Yes Yes 2 0 2 2
R:R:D248 R:R:E250 11.69 1 No No 3 2 1 2
R:R:D248 R:R:E251 16.89 1 No Yes 3 4 1 1
R:R:D248 X:X:?1 6.11 1 No Yes 3 0 1 0
R:R:E251 X:X:?1 5.97 1 Yes Yes 4 0 1 0
R:R:E251 X:X:?4 6.34 1 Yes Yes 4 0 1 1
R:R:E251 X:X:?5 12.68 1 Yes Yes 4 0 1 2
R:R:H254 X:X:?4 7.18 1 No Yes 3 0 2 1
S:S:C482 X:X:?2 11.86 1 Yes Yes 7 0 2 1
S:S:C482 X:X:?3 4.83 1 Yes Yes 7 0 2 1
S:S:C482 X:X:?6 3.8 1 Yes Yes 7 0 2 2
X:X:?1 X:X:?2 27.17 1 Yes Yes 0 0 0 1
X:X:?1 X:X:?3 6.32 1 Yes Yes 0 0 0 1
X:X:?1 X:X:?4 6.63 1 Yes Yes 0 0 0 1
X:X:?2 X:X:?3 20.99 1 Yes Yes 0 0 1 1
X:X:?2 X:X:?4 5.16 1 Yes Yes 0 0 1 1
X:X:?2 X:X:?5 5.16 1 Yes Yes 0 0 1 2
X:X:?2 X:X:?6 5.16 1 Yes Yes 0 0 1 2
X:X:?3 X:X:?4 16.8 1 Yes Yes 0 0 1 1
X:X:?3 X:X:?6 16.8 1 Yes Yes 0 0 1 2
X:X:?3 X:X:?7 2.85 1 Yes Yes 0 0 1 2
X:X:?4 X:X:?5 15.84 1 Yes Yes 0 0 1 2
X:X:?4 X:X:?6 6.16 1 Yes Yes 0 0 1 2
X:X:?4 X:X:?7 5.6 1 Yes Yes 0 0 1 2
X:X:?4 X:X:?8 4.4 1 Yes Yes 0 0 1 2
X:X:?5 X:X:?6 15.84 1 Yes Yes 0 0 2 2
X:X:?5 X:X:?7 7.84 1 Yes Yes 0 0 2 2
X:X:?5 X:X:?8 8.8 1 Yes Yes 0 0 2 2
X:X:?6 X:X:?7 19.04 1 Yes Yes 0 0 2 2
X:X:?6 X:X:?8 4.4 1 Yes Yes 0 0 2 2
X:X:?7 X:X:?8 20.16 1 Yes Yes 0 0 2 2
StatisticsValue
Average Number Of Links5.00
Average Number Of Links With An Hub4.00
Average Interaction Strength10.44
Average Nodes In Shell14.00
Average Hubs In Shell11.00
Average Links In Shell32.00
Average Links Mediated by Hubs In Shell31.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7XNA A Peptide Somatostatin SST2 Homo Sapiens CYN154806 - - 2.65 2022-08-03 10.1038/s41422-022-00679-x

A 2D representation of the interactions of ACE in 7XNA
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 L:L:?2 17.78 1 No Yes 0 0 0 1
L:L:?1 R:R:Y205 12.31 1 No Yes 0 4 0 1
L:L:?2 L:L:?3 24.15 1 Yes Yes 0 0 1 2
L:L:?2 L:L:C8 4.94 1 Yes Yes 0 0 1 2
L:L:?2 R:R:Y205 10.95 1 Yes Yes 0 4 1 1
L:L:?2 R:R:F275 9.48 1 Yes No 0 4 1 2
L:L:?2 R:R:M282 4.4 1 Yes No 0 3 1 2
L:L:?2 R:R:P286 12.78 1 Yes No 0 2 1 2
L:L:?2 R:R:L290 5.39 1 Yes No 0 4 1 2
L:L:?2 R:R:F294 11.38 1 Yes No 0 4 1 2
L:L:?3 L:L:C8 8.9 1 Yes Yes 0 0 2 2
R:R:I209 R:R:Y205 6.04 0 No Yes 5 4 2 1
R:R:S279 R:R:Y205 5.09 0 No Yes 4 4 2 1
R:R:F275 R:R:F294 13.93 1 No No 4 4 2 2
R:R:G202 R:R:Y205 1.45 0 No Yes 2 4 2 1
StatisticsValue
Average Number Of Links2.00
Average Number Of Links With An Hub2.00
Average Interaction Strength15.05
Average Nodes In Shell13.00
Average Hubs In Shell4.00
Average Links In Shell15.00
Average Links Mediated by Hubs In Shell14.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7Y66 A Peptide Complement Peptide C5A1 Homo Sapiens BM213 - Gi1/Beta1/Gamma2 2.9 2023-03-01 10.1038/s41422-023-00779-2

A 2D representation of the interactions of ACE in 7Y66
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?0 L:L:F1 3.65 0 No Yes 0 0 0 1
L:L:?0 R:R:D191 12.19 0 No No 0 4 0 1
L:L:F1 R:R:R178 9.62 0 Yes No 0 2 1 2
L:L:F1 R:R:L187 3.65 0 Yes No 0 4 1 2
L:L:F1 R:R:G189 4.52 0 Yes No 0 4 1 2
R:R:D191 R:R:S193 2.94 0 No No 4 4 1 2
L:L:?0 R:R:H194 1.93 0 No No 0 1 0 1
R:R:D191 R:R:V176 1.46 0 No No 4 4 1 2
StatisticsValue
Average Number Of Links3.00
Average Number Of Links With An Hub1.00
Average Interaction Strength5.92
Average Nodes In Shell9.00
Average Hubs In Shell1.00
Average Links In Shell8.00
Average Links Mediated by Hubs In Shell4.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7ZBC A Sensory Opsins Rhodopsin Bos Taurus 11-cis-Retinal - - 1.8 2023-03-29  10.1038/s41586-023-05863-6

A 2D representation of the interactions of ACE in 7ZBC
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
H:H:?401 H:H:?403 27.9 5 No Yes 0 0 0 1
H:H:?401 R:R:M1 6.35 5 No No 0 6 0 1
H:H:?401 R:R:N2 10.28 5 No No 0 6 0 1
H:H:?403 R:R:N2 24.64 5 Yes No 0 6 1 1
H:H:?403 R:R:G280 4.6 5 Yes No 0 1 1 2
H:H:?403 R:R:D282 6.09 5 Yes No 0 2 1 2
R:R:D282 R:R:N2 14.81 5 No No 2 6 2 1
StatisticsValue
Average Number Of Links3.00
Average Number Of Links With An Hub1.00
Average Interaction Strength14.84
Average Nodes In Shell6.00
Average Hubs In Shell1.00
Average Links In Shell7.00
Average Links Mediated by Hubs In Shell4.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
7ZBE A Sensory Opsins Rhodopsin Bos Taurus 11-cis-Retinal - - 1.8 2023-03-29  10.1038/s41586-023-05863-6

A 2D representation of the interactions of ACE in 7ZBE
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
H:H:?401 H:H:?403 26.04 4 No Yes 0 0 0 1
H:H:?401 R:R:M1 6.35 4 No No 0 6 0 1
H:H:?401 R:R:N2 10.28 4 No No 0 6 0 1
H:H:?403 R:R:N2 24.64 4 Yes No 0 6 1 1
H:H:?403 R:R:D282 6.09 4 Yes No 0 2 1 2
R:R:D282 R:R:N2 14.81 4 No No 2 6 2 1
H:H:?403 R:R:G280 3.07 4 Yes No 0 1 1 2
StatisticsValue
Average Number Of Links3.00
Average Number Of Links With An Hub1.00
Average Interaction Strength14.22
Average Nodes In Shell6.00
Average Hubs In Shell1.00
Average Links In Shell7.00
Average Links Mediated by Hubs In Shell4.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8A6C A Sensory Opsins Rhodopsin Bos Taurus All-trans-Retinal - - 1.8 2023-03-29  10.1038/s41586-023-05863-6

A 2D representation of the interactions of ACE in 8A6C
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
H:H:?401 H:H:?403 26.04 3 No Yes 0 0 0 1
H:H:?401 R:R:M1 6.35 3 No No 0 6 0 1
H:H:?401 R:R:N2 8.23 3 No No 0 6 0 1
H:H:?403 R:R:N2 23.41 3 Yes No 0 6 1 1
H:H:?403 R:R:G280 3.07 3 Yes No 0 1 1 2
H:H:?403 R:R:D282 6.09 3 Yes No 0 2 1 2
R:R:D282 R:R:N2 13.46 3 No No 2 6 2 1
StatisticsValue
Average Number Of Links3.00
Average Number Of Links With An Hub1.00
Average Interaction Strength13.54
Average Nodes In Shell6.00
Average Hubs In Shell1.00
Average Links In Shell7.00
Average Links Mediated by Hubs In Shell4.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8A6D A Sensory Opsins Rhodopsin Bos Taurus All-trans-Retinal - - 1.8 2023-03-29  10.1038/s41586-023-05863-6

A 2D representation of the interactions of ACE in 8A6D
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
H:H:?401 H:H:?403 16.74 3 No Yes 0 0 0 1
H:H:?401 R:R:M1 6.35 3 No No 0 6 0 1
H:H:?401 R:R:N2 4.11 3 No No 0 6 0 1
H:H:?403 R:R:N2 24.64 3 Yes No 0 6 1 1
H:H:?403 R:R:G280 4.6 3 Yes No 0 1 1 2
H:H:?403 R:R:D282 8.52 3 Yes No 0 2 1 2
R:R:E5 R:R:M1 4.06 0 No No 6 6 2 1
R:R:M1 R:R:Y10 3.59 0 No No 6 7 1 2
R:R:D282 R:R:N2 8.08 3 No No 2 6 2 1
StatisticsValue
Average Number Of Links3.00
Average Number Of Links With An Hub1.00
Average Interaction Strength9.07
Average Nodes In Shell8.00
Average Hubs In Shell1.00
Average Links In Shell9.00
Average Links Mediated by Hubs In Shell4.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8A6E A Sensory Opsins Rhodopsin Bos Taurus All-trans-Retinal - - 1.8 2023-03-29  10.1038/s41586-023-05863-6

A 2D representation of the interactions of ACE in 8A6E
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
H:H:?401 H:H:?403 16.74 6 No Yes 0 0 0 1
H:H:?401 R:R:M1 4.23 6 No No 0 6 0 1
H:H:?401 R:R:N2 4.11 6 No No 0 6 0 1
H:H:?403 R:R:N2 24.64 6 Yes No 0 6 1 1
H:H:?403 R:R:G280 4.6 6 Yes No 0 1 1 2
H:H:?403 R:R:D282 9.74 6 Yes No 0 2 1 2
R:R:D282 R:R:N2 10.77 6 No No 2 6 2 1
R:R:M1 R:R:Y10 3.59 0 No No 6 7 1 2
StatisticsValue
Average Number Of Links3.00
Average Number Of Links With An Hub1.00
Average Interaction Strength8.36
Average Nodes In Shell7.00
Average Hubs In Shell1.00
Average Links In Shell8.00
Average Links Mediated by Hubs In Shell4.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8FEG A Peptide Opioid KOP Homo Sapiens (DNCP)-Beta-Naloxamine - Gi1/Beta1/Gamma2 2.54 2023-12-06 10.1038/s41467-023-43718-w

A 2D representation of the interactions of ACE in 8FEG
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 L:L:Y2 12.29 3 Yes Yes 0 0 0 1
L:L:?1 L:L:?5 5.74 3 Yes Yes 0 0 0 1
L:L:?1 L:L:C7 11.88 3 Yes Yes 0 0 0 1
L:L:?1 R:R:L309 14.51 3 Yes No 0 4 0 1
L:L:?1 R:R:Y312 12.29 3 Yes Yes 0 4 0 1
L:L:A3 L:L:Y2 8.01 3 No Yes 0 0 2 1
L:L:?4 L:L:Y2 14.06 3 Yes Yes 0 0 2 1
L:L:Y2 R:R:F293 5.16 3 Yes No 0 5 1 2
L:L:Y2 R:R:E297 15.71 3 Yes No 0 5 1 2
L:L:Y2 R:R:S303 7.63 3 Yes No 0 1 1 2
L:L:Y2 R:R:S305 7.63 3 Yes No 0 3 1 2
L:L:Y2 R:R:L309 5.86 3 Yes No 0 4 1 1
L:L:?4 L:L:A3 10.08 3 Yes No 0 0 2 2
L:L:?4 L:L:?5 23.5 3 Yes Yes 0 0 2 1
L:L:?4 R:R:R202 21.37 3 Yes No 0 2 2 2
L:L:?4 R:R:S305 6 3 Yes No 0 3 2 2
L:L:?5 L:L:T6 10.89 3 Yes No 0 0 1 2
L:L:?5 L:L:C7 8.79 3 Yes Yes 0 0 1 1
L:L:?5 R:R:R202 15.7 3 Yes No 0 2 1 2
L:L:?5 R:R:E209 4.89 3 Yes Yes 0 3 1 2
L:L:T6 R:R:E209 7.06 3 No Yes 0 3 2 2
L:L:?9 L:L:C7 2.69 3 Yes Yes 0 0 2 1
L:L:C7 R:R:Y312 5.38 3 Yes Yes 0 4 1 1
R:R:Y119 R:R:Y312 2.98 3 Yes Yes 4 4 2 1
R:R:Y119 R:R:Y313 39.71 3 Yes Yes 4 4 2 2
R:R:I316 R:R:Y119 8.46 3 Yes Yes 5 4 2 2
R:R:E297 R:R:F293 13.99 3 No No 5 5 2 2
R:R:F293 R:R:Y312 9.28 3 No Yes 5 4 2 1
R:R:L309 R:R:Y313 7.03 3 No Yes 4 4 1 2
R:R:Y312 R:R:Y313 4.96 3 Yes Yes 4 4 1 2
R:R:I316 R:R:Y312 9.67 3 Yes Yes 5 4 2 1
StatisticsValue
Average Number Of Links5.00
Average Number Of Links With An Hub4.00
Average Interaction Strength11.34
Average Nodes In Shell19.00
Average Hubs In Shell11.00
Average Links In Shell31.00
Average Links Mediated by Hubs In Shell30.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8IOD A Peptide Melanocortin MC5 Homo Sapiens PG-901 Ca chim(NtGi1-Gs)/Beta1/Gamma2 2.59 2023-09-20 10.1038/s41421-023-00586-4

A 2D representation of the interactions of ACE in 8IOD
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?0 L:L:?1 21.38 4 Yes Yes 0 0 0 1
L:L:?0 R:R:V111 4.46 4 Yes No 0 3 0 1
L:L:?0 R:R:D115 16.26 4 Yes Yes 0 8 0 1
L:L:?1 L:L:D2 8.91 4 Yes No 0 0 1 2
L:L:?1 R:R:T95 5.53 4 Yes No 0 4 1 2
L:L:?1 R:R:I96 14.72 4 Yes Yes 0 4 1 2
L:L:?1 R:R:V111 4.19 4 Yes No 0 3 1 1
L:L:?1 R:R:D115 16.54 4 Yes Yes 0 8 1 1
R:R:E92 R:R:I96 4.1 4 Yes Yes 6 4 2 2
R:R:D115 R:R:E92 3.9 4 Yes Yes 8 6 1 2
R:R:D119 R:R:E92 9.09 4 Yes Yes 4 6 2 2
I:I:?1 R:R:E92 7.31 4 Yes Yes 0 6 2 2
R:R:L99 R:R:V111 4.47 0 No No 2 3 2 1
R:R:D115 R:R:D119 11.98 4 Yes Yes 8 4 1 2
I:I:?1 R:R:D115 7.49 4 Yes Yes 0 8 2 1
I:I:?1 R:R:D119 7.49 4 Yes Yes 0 4 2 2
R:R:A109 R:R:R112 2.77 0 No No 2 3 2 1
L:L:?0 R:R:R112 1.82 4 Yes No 0 3 0 1
StatisticsValue
Average Number Of Links4.00
Average Number Of Links With An Hub2.00
Average Interaction Strength10.98
Average Nodes In Shell13.00
Average Hubs In Shell7.00
Average Links In Shell18.00
Average Links Mediated by Hubs In Shell16.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8KIG A Peptide Melanocortin MC3 Homo Sapiens SHU9119 Ca - 3.1 2025-02-26 10.2210/pdb8KIG/pdb

A 2D representation of the interactions of ACE in 8KIG
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?0 L:L:?1 29.16 1 No Yes 0 0 0 1
L:L:?0 L:L:D2 4.06 1 No No 0 0 0 1
L:L:?1 L:L:D2 14 1 Yes No 0 0 1 1
L:L:?1 R:R:I98 5.35 1 Yes No 0 4 1 2
L:L:?1 R:R:I113 6.69 1 Yes No 0 8 1 2
L:L:?1 R:R:D117 15.27 1 Yes Yes 0 3 1 2
L:L:D2 L:L:K7 11.06 1 No No 0 0 1 2
StatisticsValue
Average Number Of Links2.00
Average Number Of Links With An Hub1.00
Average Interaction Strength16.61
Average Nodes In Shell7.00
Average Hubs In Shell2.00
Average Links In Shell7.00
Average Links Mediated by Hubs In Shell5.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8WKY A Peptide Melanocortin MC4 Homo sapiens PG-934 - - 2.9 2024-08-07 doi.org/10.1021/acs.jmedchem.3c01822

A 2D representation of the interactions of ACE in 8WKY
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 L:L:?2 25.27 1 No Yes 0 0 0 1
L:L:?1 L:L:K9 10.56 1 No No 0 0 0 1
L:L:?1 R:R:D122 6.1 1 No Yes 0 8 0 1
L:L:?2 R:R:I104 9.37 1 Yes No 0 4 1 2
L:L:?2 R:R:D122 12.73 1 Yes Yes 0 8 1 1
L:L:D3 L:L:K9 9.68 0 No No 0 0 2 1
L:L:R6 R:R:D122 4.76 1 Yes Yes 0 8 2 1
L:L:R6 R:R:D126 17.87 1 Yes Yes 0 4 2 2
R:R:D122 R:R:D126 9.31 1 Yes Yes 8 4 1 2
L:L:?2 R:R:T118 2.76 1 Yes No 0 6 1 2
L:L:?2 R:R:I121 2.68 1 Yes No 0 4 1 2
StatisticsValue
Average Number Of Links3.00
Average Number Of Links With An Hub2.00
Average Interaction Strength13.98
Average Nodes In Shell10.00
Average Hubs In Shell4.00
Average Links In Shell11.00
Average Links Mediated by Hubs In Shell9.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8WKZ A Peptide Melanocortin MC4 Homo sapiens SBL-MC-31 - - 3.3 2024-08-07 doi.org/10.1021/acs.jmedchem.3c01822

A 2D representation of the interactions of ACE in 8WKZ
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 L:L:?2 19.44 1 Yes Yes 0 0 0 1
L:L:?1 L:L:K9 12.67 1 Yes Yes 0 0 0 1
L:L:?1 R:R:V119 4.46 1 Yes No 0 3 0 1
L:L:?1 R:R:D122 12.19 1 Yes Yes 0 8 0 1
L:L:?2 L:L:D3 7.64 1 Yes Yes 0 0 1 2
L:L:?2 L:L:K9 5.29 1 Yes Yes 0 0 1 1
L:L:?2 R:R:I104 12.05 1 Yes Yes 0 4 1 2
L:L:?2 R:R:L107 3.89 1 Yes No 0 4 1 2
L:L:?2 R:R:D122 12.73 1 Yes Yes 0 8 1 1
L:L:D3 L:L:K9 9.68 1 Yes Yes 0 0 2 1
L:L:R6 R:R:D122 4.76 1 Yes Yes 0 8 2 1
L:L:R6 R:R:D126 17.87 1 Yes Yes 0 4 2 2
L:L:?10 L:L:K9 6.98 0 No Yes 0 0 2 1
R:R:D122 R:R:D126 10.65 1 Yes Yes 8 4 1 2
StatisticsValue
Average Number Of Links4.00
Average Number Of Links With An Hub3.00
Average Interaction Strength12.19
Average Nodes In Shell11.00
Average Hubs In Shell8.00
Average Links In Shell14.00
Average Links Mediated by Hubs In Shell14.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8XGO A Peptide Kisspeptin Kiss1 Homo Sapiens TAK448 - chim(NtGi1-Gq)/Beta1/Gamma2 2.68 2024-10-30 doi.org/10.1126/sciadv.adn7771

A 2D representation of the interactions of ACE in 8XGO
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
R:R:D41 R:R:Y299 4.6 3 No No 2 4 2 2
R:R:D41 R:R:Y302 6.9 3 No Yes 2 5 2 1
R:R:Y103 R:R:Y302 7.94 3 Yes Yes 5 5 2 1
R:R:T306 R:R:Y103 4.99 3 No Yes 4 5 2 2
R:R:Y299 R:R:Y302 4.96 3 No Yes 4 5 2 1
R:R:T306 R:R:Y302 6.24 3 No Yes 4 5 2 1
L:L:?1 R:R:Y302 7.02 0 No Yes 0 5 0 1
L:L:Y2 R:R:Y302 3.97 0 No Yes 0 5 2 1
StatisticsValue
Average Number Of Links1.00
Average Number Of Links With An Hub1.00
Average Interaction Strength7.02
Average Nodes In Shell7.00
Average Hubs In Shell2.00
Average Links In Shell8.00
Average Links Mediated by Hubs In Shell7.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
Show PDB Class SubFamily Type SubType Species Orthosteric Ligand Other Ligand(s) Protein Partners Resolution Date DOI
8XGU A Peptide Kisspeptin Kiss1 Homo Sapiens TAK448 - Gi1/Beta1/Gamma2 3 2024-10-30 doi.org/10.1126/sciadv.adn7771

A 2D representation of the interactions of ACE in 8XGU
colored according to ConSurf Conservation Grade (See documentation): 

 n/a   1    2    3    4    5    6    7    8    9  

(Click to enlarge 🔍)

Node1 Node2 LinkStrength Comm IsNode1Hub? IsNode2Hub? Node1Cons Node2Cons Node1Shell Node2Shell
L:L:?1 L:L:?2 19.89 6 No Yes 0 0 0 1
L:L:?1 L:L:?3 9.72 6 No Yes 0 0 0 1
L:L:?1 L:L:T5 4.41 6 No Yes 0 0 0 1
L:L:?2 L:L:?3 20.76 6 Yes Yes 0 0 1 1
L:L:?2 L:L:T5 3.54 6 Yes Yes 0 0 1 1
L:L:?2 R:R:Y299 7.5 6 Yes No 0 4 1 2
L:L:?2 R:R:Y302 2.81 6 Yes Yes 0 5 1 2
L:L:?3 L:L:N4 5.15 6 Yes No 0 0 1 2
L:L:?3 L:L:T5 2.76 6 Yes Yes 0 0 1 1
L:L:?3 R:R:Y190 11 6 Yes Yes 0 4 1 2
L:L:N4 R:R:Y190 11.63 6 No Yes 0 4 2 2
L:L:F6 L:L:T5 9.08 6 Yes Yes 0 0 2 1
L:L:T5 R:R:Y302 7.49 6 Yes Yes 0 5 1 2
StatisticsValue
Average Number Of Links3.00
Average Number Of Links With An Hub3.00
Average Interaction Strength11.34
Average Nodes In Shell9.00
Average Hubs In Shell6.00
Average Links In Shell13.00
Average Links Mediated by Hubs In Shell13.00

Physico-chemical properties of the nodes interacting with this ligand (click to enlarge 🔍)

Location of the nodes interacting with this ligand (click to enlarge 🔍)
StatisticsValue
Average Number Of Links3.24
Average Number Of Links With An Hub1.95
Average Interaction Strength10.96
Average Nodes In Shell10.10
Average Hubs In Shell4.43
Average Links In Shell13.71
Average Links Mediated by Hubs In Shell11.71

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Physico-chemical properties of the nodes interacting with this ligand

(Click to enlarge 🔍)

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Location of the nodes interacting with this ligand

(Click to enlarge 🔍)