Structure of PDB 9j0u Chain A Binding Site BS01

Receptor Information
>9j0u Chain A (length=286) Species: 28223 (Desulfobacula toluolica) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MKREAIHNFFVANQIIKSTADMAIFDKVPATAIYEVMQVRQGIPLFFEAH
LERFVMSASLVGTRIPKKEAEILHNIADLVEKNKCDHGNVKLVSALMNEK
EIFLAYFIPAEFLDSKARLEGVHTILFSGERICPNIKTIKGSFREQVKAV
RESSNAYEALLVNESGHITEGSRSNVFFMGKDNKLYTSPAGSVLKGVTRT
HVMQICSRLGLEVLEKTVHTRNLADIQGAFITGTTVDVTPVRSIGNTQLD
SPNIPLIRKIVAEYEKKIAGYVSKRLKRARKVYVND
Ligand information
Ligand IDPLP
InChIInChI=1S/C8H10NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2-3,11H,4H2,1H3,(H2,12,13,14)
InChIKeyNGVDGCNFYWLIFO-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341Cc1ncc(CO[P](O)(O)=O)c(C=O)c1O
OpenEye OEToolkits 1.5.0Cc1c(c(c(cn1)COP(=O)(O)O)C=O)O
ACDLabs 10.04O=P(O)(O)OCc1cnc(c(O)c1C=O)C
FormulaC8 H10 N O6 P
NamePYRIDOXAL-5'-PHOSPHATE;
VITAMIN B6 Phosphate
ChEMBLCHEMBL82202
DrugBankDB00114
ZINCZINC000001532514
PDB chain9j0u Chain A 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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PDB9j0u High/low resolution monomeric PLP-dependent transaminase from Desulfobacula toluolica
Resolution2.58 Å
Binding residue
(original residue number in PDB)		R53 R131 K137 E170 S172 R173 S174 L194 G196 V197 T198 G233 T234
Binding residue
(residue number reindexed from 1)		R53 R131 K137 E170 S172 R173 S174 L194 G196 V197 T198 G233 T234
Annotation score4
External links