Structure of PDB 8v35 Chain A Binding Site BS01

Receptor Information
>8v35 Chain A (length=431) Species: 264198 (Cupriavidus pinatubonensis JMP134) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GMISYLKKAEKTPETATAQKVVTEMLAEIQARGKDAVRQYAKQLDGWSGD
IVLTPDQIREQTKDVPAGVRADIDFAIRQVTDFALAQRESLKEFSVELHP
GVTAGQRVLPVNVVGCYAPAGRYAHIASAYMGVATAKAAGVKTVVACSSP
FRGQGIHPHVLYAFQAAGADVIMALGGVQAIASMAYGLFTGKPADVVVGP
GNKFVAEAKRSLYGQVGIDVFAGPSEVAVIADETADPAIVASDLVGQAEH
GHESPAWLFTTSRDLADRVMALVPELIAKLPPTARDAATAAWRDYGEVIL
CGTREEVVEISDRYASEHLEVHTADLDWWLANLTCYGSLFLGEETTVAFG
DKTSGPNHVLPARYSGGLSVHKFMKTLTWQQMTREATRQIGQVTARISRL
EGMEAHARTADDRMAKYFPNASFEMGTPVEV
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 chain8v35 Chain A Residue 502 [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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PDB8v35 Structural and kinetic insights into the stereospecific oxidation of R -2,3-dihydroxypropanesulfonate by DHPS-3-dehydrogenase from Cupriavidus pinatubonensis.
Resolution1.94 Å
Binding residue
(original residue number in PDB)		H126 Q248 H251
Binding residue
(residue number reindexed from 1)		H125 Q247 H250
Annotation score1
External links
PDB RCSB:8v35, PDBe:8v35, PDBj:8v35
PDBsum8v35
PubMed39263660
UniProtQ46N53|HPSN_CUPPJ Sulfopropanediol 3-dehydrogenase (Gene Name=hpsN)

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