Structure of PDB 7ycf Chain A Binding Site BS05
Receptor Information
>7ycf Chain A (length=166) Species:
291247
(Oxidus gracilis) [
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DEDPMTCDKLPKVPVPPLEEFIKSNPLQFAYVLTDTFDCTTRVYVQPARL
SPNQAATALDIRGSRIITNDFVGGPNNSAILNNCTTGEKATWYFQYTNLN
TPNGSSYCAYTCNGEEIAEYKCANNNNGTDPLQKQAVEVAKKVPNGDKIH
YALDNCPEHHGCFAFY
Ligand information
Ligand ID
SO4
InChI
InChI=1S/H2O4S/c1-5(2,3)4/h(H2,1,2,3,4)/p-2
InChIKey
QAOWNCQODCNURD-UHFFFAOYSA-L
SMILES
Software
SMILES
OpenEye OEToolkits 1.5.0
[O-]S(=O)(=O)[O-]
CACTVS 3.341
[O-][S]([O-])(=O)=O
ACDLabs 10.04
[O-]S([O-])(=O)=O
Formula
O4 S
Name
SULFATE ION
ChEMBL
DrugBank
DB14546
ZINC
PDB chain
7ycf Chain A Residue 206 [
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Receptor-Ligand Complex Structure
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PDB
7ycf
Structure-based site-directed mutagenesis of hydroxynitrile lyase from cyanogenic millipede, Oxidus gracilis for enhancing catalytic efficiency and enantioselectivity
Resolution
2.01 Å
Binding residue
(original residue number in PDB)
K141 H150 Y151
Binding residue
(residue number reindexed from 1)
K141 H150 Y151
Annotation score
3
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:7ycf
,
PDBe:7ycf
,
PDBj:7ycf
PDBsum
7ycf
PubMed
38526556
UniProt
A0A2Z5XCT7
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