Structure of PDB 6kfb Chain A Binding Site BS01

Receptor Information
>6kfb Chain A (length=162) Species: 1551368 (Chamberlinius hualienensis) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
LTCDQLPKAAINPIQEFIDSNPLEFEYVLTETFECTTRIYVQPARWSTTK
APTALDIKGTQIMAYDFVGGPENSAHLNECHTGDKQVWYFQYTNLLTDNG
SSYCAYRCNGTEIIEYKCASNNNGTDPLQHQAMEVAKTVPNGDKIHYAKS
NCPETHGCFAFY
Ligand information
Ligand IDSCN
InChIInChI=1S/CHNS/c2-1-3/h3H/p-1
InChIKeyZMZDMBWJUHKJPS-UHFFFAOYSA-M
SMILES
SoftwareSMILES
OpenEye OEToolkits 1.5.0C(#N)[S-]
ACDLabs 10.04
CACTVS 3.341		[S-]C#N
FormulaC N S
NameTHIOCYANATE ION
ChEMBL
DrugBank
ZINC
PDB chain6kfb Chain A Residue 201 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6kfb R-hydroxynitrile lyase from the cyanogenic millipede, Chamberlinius hualienensis-A new entry to the carrier protein family Lipocalines.
Resolution1.55 Å
Binding residue
(original residue number in PDB)		R38 Y103 K117
Binding residue
(residue number reindexed from 1)		R38 Y103 K117
Annotation score3
Enzymatic activity
Enzyme Commision number ?
Gene Ontology

View graph for
Molecular Function
External links
PDB RCSB:6kfb, PDBe:6kfb, PDBj:6kfb
PDBsum6kfb
PubMed32679618
UniProtA0A0H5BR52

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