Structure of PDB 6s7m Chain A Binding Site BS01

Receptor Information
>6s7m Chain A (length=67) Species: 5702 (Trypanosoma brucei brucei) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
MWHTHSEREKRVSNAVEFLLDSRVRRTPTSSKVHFLKSKGLSAEEICEAF
TKVGQPKTLNEIKRILS
Ligand information
Ligand IDKZ2
InChIInChI=1S/C9H6O2S/c10-9(11)7-3-1-2-6-4-5-12-8(6)7/h1-5H,(H,10,11)
InChIKeyLJPSRTWIAXVPIS-UHFFFAOYSA-N
SMILES
SoftwareSMILES
OpenEye OEToolkits 2.0.7c1cc2ccsc2c(c1)C(=O)O
CACTVS 3.385OC(=O)c1cccc2ccsc12
FormulaC9 H6 O2 S
Name1-benzothiophene-7-carboxylic acid
ChEMBL
DrugBank
ZINCZINC000012370194
PDB chain6s7m Chain A Residue 101 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
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PDB6s7m Structure of parasitic PEX14 in complex with a benzo[b]thiophene-7-carboxylic acid.
Resolution1.75846 Å
Binding residue
(original residue number in PDB)		K36 A42 K62
Binding residue
(residue number reindexed from 1)		K37 A43 K63
Annotation score1
Enzymatic activity
Enzyme Commision number ?
Gene Ontology
Biological Process
GO:0016560 protein import into peroxisome matrix, docking
Cellular Component
GO:0005778 peroxisomal membrane

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Biological Process
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Cellular Component
External links
PDB RCSB:6s7m, PDBe:6s7m, PDBj:6s7m
PDBsum6s7m
PubMed
UniProtQ8IEW2

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