Structure of PDB 7d5n Chain B Binding Site BS02

Receptor Information
>7d5n Chain B (length=389) Species: 322710 (Azotobacter vinelandii DJ) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
INGSKRIAQPIRWAMVGGGRNSQIGYIHRSAALRDQSFALVAGAFDIDPG
RGREFGVQLGVDPQRCYPDYRTLFEQEARRPDGIQAVSVATPNGTHFAIT
RAALEAGLHVVCEKPLCFTLEEAETLREIALANNRVVGVTYGYAGHQLIE
QARAMIADGELGEIRMVHMQFAHGFHSAPVEGQNEATKWRVDPRLAGPSY
VLGDVGTHPLYLSEVMLPEFRIKRLMCSRQSFVKSRAPLEDNAYTLMEYE
GGAMGLVWSSAVNAGSMHGQKIRVIGSRASLEWWDEHPNQLAFEIQGQPV
QVLERGMGYLHPGALLDDRIGAGHPEGLFEAWSNLYYRFAMAMDATERGD
GALLAGLRYPDIHAGVEGVRWVERCVQSADRGGVWVDYL
Ligand information
Ligand IDINS
InChIInChI=1S/C6H12O6/c7-1-2(8)4(10)6(12)5(11)3(1)9/h1-12H/t1-,2-,3-,4+,5-,6-
InChIKeyCDAISMWEOUEBRE-GPIVLXJGSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C1(C(C(C(C(C1O)O)O)O)O)O
ACDLabs 10.04OC1C(O)C(O)C(O)C(O)C1O
CACTVS 3.341O[CH]1[CH](O)[CH](O)[CH](O)[CH](O)[CH]1O
CACTVS 3.341O[C@@H]1[C@H](O)[C@H](O)[C@@H](O)[C@H](O)[C@H]1O
FormulaC6 H12 O6
Name1,2,3,4,5,6-HEXAHYDROXY-CYCLOHEXANE;
MYO-INOSITOL
ChEMBLCHEMBL1222251
DrugBankDB13178
ZINCZINC000100018867
PDB chain7d5n Chain B 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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PDB7d5n Crystal structure of inositol dehydrogenase complexed with NADH and myo-inositol from Azotobacter vinelandii
Resolution1.8 Å
Binding residue
(original residue number in PDB)		K115 Y144 R191 D205 H209
Binding residue
(residue number reindexed from 1)		K114 Y143 R190 D204 H208
Annotation score4
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Molecular Function
GO:0000166 nucleotide binding

View graph for
Molecular Function
External links
PDB RCSB:7d5n, PDBe:7d5n, PDBj:7d5n
PDBsum7d5n
PubMed
UniProtC1DLC3

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