Structure of PDB 6yak Chain AAA Binding Site BS02

Receptor Information
>6yak Chain AAA (length=282) Species: 129958 (Carboxydothermus hydrogenoformans) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
DDMQDEILNLKLIANQLRQHVVKMVGEANSGHPGGSLSAADILAVLFFKE
MRIDPANPKWQDRDRFVLSKGHASPVLYAALAERGFFPKEWLSQFRKINS
PLQGHPDMKKVPGVEMSTGSLGQGFSTAVGMALGLKLDRSPARVYVLLGD
GEIQEGIVWEAAMAAAHYKLNNLTAILDYNGLQIDGPVQEVMNPEPVADK
WRSFGFKVITVDGHNIPEIINAIDAARLHLEGPTIIIAKTVKGKGVSFME
NRVEWHGSAPKPEQVAEALSELQVGREKLWEE
Ligand information
Ligand IDCA
InChIInChI=1S/Ca/q+2
InChIKeyBHPQYMZQTOCNFJ-UHFFFAOYSA-N
SMILES
SoftwareSMILES
CACTVS 3.341[Ca++]
ACDLabs 10.04
OpenEye OEToolkits 1.5.0
[Ca+2]
FormulaCa
NameCALCIUM ION
ChEMBL
DrugBankDB14577
ZINC
PDB chain6yak Chain AAA Residue 302 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6yak A 'Split-Gene' Transketolase From the Hyper-Thermophilic Bacterium Carboxydothermus hydrogenoformans : Structure and Biochemical Characterization.
Resolution1.34 Å
Binding residue
(original residue number in PDB)
D148 N178 L180
Binding residue
(residue number reindexed from 1)
D150 N180 L182
Annotation score4
External links