Structure of PDB 5t53 Chain A Binding Site BS02

Receptor Information
>5t53 Chain A (length=187) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
FGAVSCNVCGMLYTPEDETQHLLFHNQFISAVKYVGWKKERILAEYPDGR
IIMVLPEDPKYALKKVDEIREMVDNDLGMCYSRTKTLLFISNDKKVVGCL
IAEHIQWGYRVIEEKLPAWCCSTLPEPAICGISRIWVFSMMRRKKIASRM
IECLRSNFIYGSYLSKEEIAFSDPTPDGKLFATQYCG
Ligand information
Ligand IDZN
InChIInChI=1S/Zn/q+2
InChIKeyPTFCDOFLOPIGGS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Zn++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0		[Zn+2]
FormulaZn
NameZINC ION
ChEMBLCHEMBL1236970
DrugBankDB14532
ZINC
PDB chain5t53 Chain A Residue 902 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB5t53 Molecular Basis for Cohesin Acetylation by Establishment of Sister Chromatid Cohesion N-Acetyltransferase ESCO1.
Resolution2.699 Å
Binding residue
(original residue number in PDB)		C619 C622 H637 H641
Binding residue
(residue number reindexed from 1)		C6 C9 H21 H25
Annotation score1
Enzymatic activity
Enzyme Commision number 2.3.1.-
External links
PDB RCSB:5t53, PDBe:5t53, PDBj:5t53
PDBsum5t53
PubMed27803161
UniProtQ5FWF5|ESCO1_HUMAN N-acetyltransferase ESCO1 (Gene Name=ESCO1)

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