Structure of PDB 8jik Chain A Binding Site BS01

Receptor Information
>8jik Chain A (length=410) Species: 4442 (Camellia sinensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
TSLTITEPEAFMAGVLVRYRKTLIEKTKYHLGYPFNLDLDYGPLAELQHF
AINNLGDPFIESNYGVHSRQFEVGVLDWFARLWEIEQKEYWGYITNGGTE
GNLHGILIGREVFPDGIFYTSRESHYSIFKAARMYRMECVKVGTLINGEI
DCADFKAKLLSNKDKPAIINLNIGTTVKGAVDDIDLVIQTLEECGFSHDR
FYIHCDGALFGFMMPFLNRGPKITFKKPIGSVSVSGHKFMGCPTPCGVQI
TRLEHINALSRNVEYLASRDATITGSRNGHSPIILWYALNRKGFKGFQKE
VQKCLRNAHYLKDRLREAGISAMLNELSSTVVFERPLDEEFVRRWQLACE
GNMAHVIVMPNVTIEKLDEFLNELVQKRANWYNDGKAGPPCLAPDIGSEN
CDCDLHKLEH
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 chain8jik Chain A Residue 501 [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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PDB8jik Crystal structure of alanine decarboxylase
Resolution2.6 Å
Binding residue
(original residue number in PDB)		G169 T170 H196 T247 D277 A279 H308 K309
Binding residue
(residue number reindexed from 1)		G98 T99 H125 T176 D206 A208 H237 K238
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links