Structure of PDB 7m6u Chain A Binding Site BS01

Receptor Information
>7m6u Chain A (length=391) Species: 312 (Pseudomonas sp. RS-16) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VGDNIVGKIKGRGGKNLLLMSHMDTVYLKGILAKAPFRVEGDKAYGPGIA
DDKGGNAVILHTLKLLKEYGVRDYGTITVLFNTDEEAGSFGSRDLIQEEA
KLADYVLSFEPTSAGDEKLSLGTSGIAYVQVNITGKASHAGAAPELGVNA
LVEASDLVLRTMNIDDKAKNLRFNWTIAKAGNVSNIIPASATLNADVRYA
RNEDFDAAMKTLEERAQQKKLPEADVKVIVTRGRPAFNAGEGGKKLVDKA
VAYYKEAGGTLGVEERTGGGTDAAYAALSGKPVIESLGLPGFGYHSDKAE
YVDISAIPRRLYMAARLIMDLGAGKASAQKRDNVLFQAATDEQPAVIKTL
EKLVNIETGTGDAEGIAAAGNFLEAELKNLGFTVTRSKSAG
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 chain7m6u Chain A Residue 500 [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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PDB7m6u Massively parallel, computationally guided design of a proenzyme.
Resolution2.59 Å
Binding residue
(original residue number in PDB)		D50 E85 H294
Binding residue
(residue number reindexed from 1)		D51 E86 H295
Annotation score4
Enzymatic activity
Enzyme Commision number 3.4.17.11: glutamate carboxypeptidase.
Gene Ontology
Molecular Function
GO:0016787 hydrolase activity

View graph for
Molecular Function
External links
PDB RCSB:7m6u, PDBe:7m6u, PDBj:7m6u
PDBsum7m6u
PubMed35377786
UniProtP06621|CBPG_PSES6 Carboxypeptidase G2 (Gene Name=cpg2)

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