Ligand name: (2~{R})-2-[[4-[(4-aminocarbonylphenyl)carbonylamino]phenyl]sulfonylamino]-5-[(2~{S},4~{S})-4-azanyl-2-[[(2~{S})-1-[[(2~{S})-1-[(5-azanyl-5-oxidanylidene-pentyl)amino]-5-oxidanyl-1,5-bis(oxidanylidene)pentan-2-yl]-methyl-amino]-4-methyl-1-oxidanylidene-pentan-2-yl]carbamoyl]pyrrolidin-1-yl]-5-oxidanylidene-pentanoic acid
PDB ligand accession: L2U
DrugBank: n/a
PubChem:
166451148
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ChEMBL:
CHEMBL5412341
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InChI Key: XGGNDAOPHPLHFW-PVNIVXITSA-N
SMILES: CC(C)CC(C(=O)N(C)C(CCC(=O)O)C(=O)NCCCCC(=O)N)NC(=O)C1CC(CN1C(=O)CCC(C(=O)O)NS(=O)(=O)c2ccc(cc2)NC(=O)c3ccc(cc3)C(=O)N)N
Drug action: n/a
No PTM data available
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List of PDB structures and/or AlphaFold models with target protein P08253
PDB/AF Accession |
PyMOL script |
Experimental / Predicted |
Interacting ECOD domains |
ECOD X-group name |
LigPlot |
8H78
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Download
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Experimental
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e8h78A1 e8h78B1 |
Zincin-like
Zincin-like
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LigPlot
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