DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Neutrophil gelatinase-associated lipocalin
Ligand Name
9-{hydroxy[(5S,6R)-6-hydroxy-6-{[(1S)-3-{[(3S)-1-hydroxy-2-oxoazepan-3-yl]amino}-1-methyl-3-oxopropyl]oxy}-5-({[(4S)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-oxazol-4-yl]carbonyl}amino)hexyl]amino}-9-oxononanoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IAYIKQLBDQWIRR-QMSOLXAJSA-N
SMILES
CC(CC(=O)NC1CCCCN(C1=O)O)OC(C(CCCCN(C(=O)CCCCCCCC(=O)O)O)NC(=O)C2COC(=N2)c3ccccc3O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 3PEC
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Color Legend
Unassigned regionsLigand / hetero atomse3pecA1e3pecB1e3pecC1
ECOD domains from experimental PDB structures interacting with ligand ZYG
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P80188n/aZYG3pece3pecC1C:4-178