Structure of PDB 7zvo Chain A Binding Site BS02

Receptor Information
>7zvo Chain A (length=131) Species: 226186 (Bacteroides thetaiotaomicron VPI-5482) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
SSGPQQGLRYEAETATLKGKFRKKEHRKQTGVFFDKGKGNSIEWNISTGL
AQVYALRFKYMNTTGKPMPVLMKFIDSKGVVLKEDILTFPETPDKWKMMS
TTTGTFINAGHYKVLLSAENMDGLAFDALDI
Ligand information
Ligand IDALA
InChIInChI=1S/C3H7NO2/c1-2(4)3(5)6/h2H,4H2,1H3,(H,5,6)/t2-/m0/s1
InChIKeyQNAYBMKLOCPYGJ-REOHCLBHSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0CC(C(=O)O)N
CACTVS 3.341C[CH](N)C(O)=O
ACDLabs 10.04O=C(O)C(N)C
CACTVS 3.341C[C@H](N)C(O)=O
OpenEye OEToolkits 1.5.0C[C@@H](C(=O)O)N
FormulaC3 H7 N O2
NameALANINE
ChEMBLCHEMBL279597
DrugBankDB00160
ZINCZINC000004658553
PDB chain7zvo Chain A Residue 204 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB7zvo The structure of a Bacteroides thetaiotaomicron carbohydrate-binding module provides new insight into the recognition of complex pectic polysaccharides by the human microbiome.
Resolution1.65 Å
Binding residue
(original residue number in PDB)		G17 L18 D140
Binding residue
(residue number reindexed from 1)		G7 L8 D130
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links