Structure of PDB 5uqp Chain A Binding Site BS01

Receptor Information
>5uqp Chain A (length=110) Species: 101510 (Rhodococcus jostii RHA1) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SVNGRLPELDFENRPSGAKLGIFDLPKLEVSVAPFTLAHIRVPGGVTTAE
DHHEVREIWLVQSGSGILTLDGVRSRVRAGDTLYYESYRRHQLHNDGDSP
VEIVSIWWRP
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 chain5uqp Chain A Residue 201 [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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PDB5uqp The crystal structure of cupin protein from Rhodococcus jostii RHA1
Resolution2.4 Å
Binding residue
(original residue number in PDB)
D63 H65 E69 H103
Binding residue
(residue number reindexed from 1)
D51 H53 E57 H91
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0046872 metal ion binding

View graph for
Molecular Function
External links
PDB RCSB:5uqp, PDBe:5uqp, PDBj:5uqp
PDBsum5uqp
PubMed
UniProtQ0RYE0|CUPN2_RHOJR Cupin 2 conserved barrel domain-containing protein (Gene Name=RHA1_ro08652)

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