Structure of PDB 8v0a Chain B Binding Site BS01

Receptor Information
>8v0a Chain B (length=249) Species: 32630 (synthetic construct) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
ARKFFVGGNWKMNGSVESIKSLVETLNNAELDPNVEVVIAPPAVYLPLVR
EALRKDIQVAAQNCYTKASGAYTGEISAEMLKDLGIPWVILGHSERRHIF
GESDELVAEKTKYALDSGLSVILCIGETLEEREAGKTMDVVARQLKAIAD
KITENDWSKVVIAYEPVWAIGTGKVATPEQAQEVHAEIRKWLAENVSAEV
AESTRIIYGGSVNGGNCKELAKQPDIDGFLVGGASLKPEFVDIINAKQA
Ligand information
Ligand IDPGH
InChIInChI=1S/C2H6NO6P/c4-2(3-5)1-9-10(6,7)8/h5H,1H2,(H,3,4)(H2,6,7,8)
InChIKeyBAXHHWZKQZIJID-UHFFFAOYSA-N
SMILES
SoftwareSMILES
ACDLabs 10.04O=P(O)(O)OCC(=O)NO
OpenEye OEToolkits 1.5.0C(C(=O)NO)OP(=O)(O)O
CACTVS 3.341ONC(=O)CO[P](O)(O)=O
FormulaC2 H6 N O6 P
NamePHOSPHOGLYCOLOHYDROXAMIC ACID
ChEMBLCHEMBL371668
DrugBankDB03026
ZINC
PDB chain8v0a Chain B Residue 301 [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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PDB8v0a Stable monomers in the ancestral sequence reconstruction of the last opisthokont common ancestor of dimeric triosephosphate isomerase.
Resolution2.05 Å
Binding residue
(original residue number in PDB)		N10 K12 H94 S212 L231 G233
Binding residue
(residue number reindexed from 1)		N9 K11 H93 S211 L230 G232
Annotation score1
External links