Structure of PDB 7shw Chain A Binding Site BS03
Receptor Information
>7shw Chain A (length=254) Species:
1772
(Mycolicibacterium smegmatis) [
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IAKIPLDIDTSLVSDGTATAFDPDSLVAERFKIDRDVPVALQQQMSVEAP
SNADVVTFQVGTTLRRTDRQQDAGLLLALVDTVTMNRNTAEAVLPHEGLT
YRFPFDTEKKTYPFFDPIAQKAFDANYDGEEDVNGLTTYRFVQNVGYDAD
GKLADPIKYSASVTARAEVWGVPGEPDESITMDRFYAASRTFWVDPVSGT
IVKSEEHGYQYYAREALKPEVTYVDFKVTTNEESVESQVAAASDERDRIA
LWTR
Ligand information
Ligand ID
XE
InChI
InChI=1S/Xe
InChIKey
FHNFHKCVQCLJFQ-UHFFFAOYSA-N
SMILES
Software
SMILES
ACDLabs 10.04
CACTVS 3.341
OpenEye OEToolkits 1.5.0
[Xe]
Formula
Xe
Name
XENON
ChEMBL
CHEMBL1236802
DrugBank
DB13453
ZINC
PDB chain
7shw Chain A Residue 403 [
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Receptor-Ligand Complex Structure
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PDB
7shw
Crystal structure of the putative cell-wall lipoglycan biosynthesis protein LmcA from Mycobacterium smegmatis.
Resolution
1.79 Å
Binding residue
(original residue number in PDB)
F56 Y281
Binding residue
(residue number reindexed from 1)
F21 Y212
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:7shw
,
PDBe:7shw
,
PDBj:7shw
PDBsum
7shw
PubMed
35362472
UniProt
A0QP93
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