Structure of PDB 3sxm Chain B Binding Site BS01

Receptor Information
>3sxm Chain B (length=137) Species: 2336 (Thermotoga maritima) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
GAMDEKFIRETIETRIMMEVFCLENYFDKIAGSEELLEIKGEIDDVAARE
IFDDSDERLHKLFIRASGNELIISLYEKIWDRIDLVRHLNERYVVSNREH
KELIERIISGDKEGAIEKLKEHLKNVEAETIKNLYTY
Ligand information
Ligand IDBCT
InChIInChI=1S/CH2O3/c2-1(3)4/h(H2,2,3,4)/p-1
InChIKeyBVKZGUZCCUSVTD-UHFFFAOYSA-M
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(=O)(O)[O-]
CACTVS 3.341OC([O-])=O
ACDLabs 10.04[O-]C(=O)O
FormulaC H O3
NameBICARBONATE ION
ChEMBL
DrugBank
ZINC
PDB chain3sxm Chain B Residue 2 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB3sxm Structure of Thermotoga maritima TM0439: implications for the mechanism of bacterial GntR transcription regulators with Zn2+-binding FCD domains.
Resolution1.55 Å
Binding residue
(original residue number in PDB)		S104 E105 E106 R139
Binding residue
(residue number reindexed from 1)		S33 E34 E35 R65
Annotation score4
Enzymatic activity
Enzyme Commision number ?
External links