Structure of PDB 6xqi Chain C Binding Site BS02

Receptor Information
>6xqi Chain C (length=63) Species: 11698 (Human immunodeficiency virus type 1 (NEW YORK-5 ISOLATE)) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
NEWTLELLEELKSEAVRHFPRIWLHNLGQHIYETYGDTWAGVEAIIRILQ
QLLFIHFRIGCSH
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 chain6xqi Chain C Residue 101 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6xqi Structure of HIV-1 Vpr in complex with the human nucleotide excision repair protein hHR23A.
Resolution2.34 Å
Binding residue
(original residue number in PDB)		H33 H71 C76 H78
Binding residue
(residue number reindexed from 1)		H18 H56 C61 H63
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0019058 viral life cycle
Cellular Component
GO:0042025 host cell nucleus

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Biological Process
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Cellular Component
External links
PDB RCSB:6xqi, PDBe:6xqi, PDBj:6xqi
PDBsum6xqi
PubMed34824204
UniProtP12520|VPR_HV1N5 Protein Vpr (Gene Name=vpr)

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