Structure of PDB 6m4j Chain A Binding Site BS01

Receptor Information
>6m4j Chain A (length=347) Species: 47951 (Vibrio cyclitrophicus) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TKYFDYAASTPVAKGVLESMKPWQSDSFANPSAAHIEAEKALNAIKQARE
IIADTLGAMPSEIVFTCGASESNNLAIKGLAFKRLEEKGHLITSSIEHKC
VLNTCGFLESIGFDVTYLTPKASGLISAQQVEEAIRPNTFLITIHHVNNE
LGTVQPIEDIGNVAFEHDIPFHTDAAQSFCKLDIDVDDMNIDMLSLSGHK
VYGPKGIGALYVRDARNSELVPLIHGGGQELGLRGGTSPTPLIVGLGVAV
EHFPSEASAQQTEFEKIINEYSFSRNSGDNALSTTWNVTFENDDEVKRFT
SERNWLISQGSASNAMSNTPSHVLTAIGLSEAEARRTYRISLPPYKV
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 chain6m4j Chain A Residue 401 [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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PDB6m4j Structural Analysis of an l-Cysteine Desulfurase from an Ssp DNA Phosphorothioation System.
Resolution1.8 Å
Binding residue
(original residue number in PDB)		G69 A70 S71 H99 D175 A177 Q178 S198 H200 K201
Binding residue
(residue number reindexed from 1)		G68 A69 S70 H98 D174 A176 Q177 S197 H199 K200
Annotation score4
External links