Structure of PDB 5xve Chain A Binding Site BS01

Receptor Information
>5xve Chain A (length=331) Species: 9606 (Homo sapiens) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
AQGLAGLRNLGNTSFMNSILQCLSNTRELRDYCLQRLYMRDLHHGSNAHT
ALVEEFAKLIQTIWTSSPNDVVSPSEFKTQIQRYAPRFVGYNQQDAQEFL
RFLLDGLHNEVNRVTLENLDHLPDDEKGRQMWRKYLEREDSRIGDLFVGQ
LKSSLTCTDCGYCSTVFDPFWDLSLPIAKRGYPEVTLMDCMRLFTKEDVL
DGDEKPTCCRCRGRKRCIKKFSIQRFPKILVLHLKRFSESRIRTSKLTTF
VNFPLRDLDLREFASENTNHAVYNLYAVSNHSGTTMGGHYTAYCRSPGTG
EWHTFNDSSVTPMSSSQVRTSDAYLLFYELA
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 chain5xve Chain A Residue 701 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB5xve 6-Thioguanine is a noncompetitive and slow binding inhibitor of human deubiquitinating protease USP2
Resolution1.24 Å
Binding residue
(original residue number in PDB)		C425 C428 C476 C479
Binding residue
(residue number reindexed from 1)		C157 C160 C208 C211
Annotation score4
Enzymatic activity
Enzyme Commision number 3.4.19.12: ubiquitinyl hydrolase 1.
Gene Ontology
Molecular Function
GO:0004843 cysteine-type deubiquitinase activity
Biological Process
GO:0016579 protein deubiquitination

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Molecular Function
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Biological Process
External links
PDB RCSB:5xve, PDBe:5xve, PDBj:5xve
PDBsum5xve
PubMed29449607
UniProtO75604|UBP2_HUMAN Ubiquitin carboxyl-terminal hydrolase 2 (Gene Name=USP2)

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