Structure of PDB 6m4j Chain A Binding Site BS02
Receptor Information
>6m4j Chain A (length=347) Species:
47951
(Vibrio cyclitrophicus) [
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TKYFDYAASTPVAKGVLESMKPWQSDSFANPSAAHIEAEKALNAIKQARE
IIADTLGAMPSEIVFTCGASESNNLAIKGLAFKRLEEKGHLITSSIEHKC
VLNTCGFLESIGFDVTYLTPKASGLISAQQVEEAIRPNTFLITIHHVNNE
LGTVQPIEDIGNVAFEHDIPFHTDAAQSFCKLDIDVDDMNIDMLSLSGHK
VYGPKGIGALYVRDARNSELVPLIHGGGQELGLRGGTSPTPLIVGLGVAV
EHFPSEASAQQTEFEKIINEYSFSRNSGDNALSTTWNVTFENDDEVKRFT
SERNWLISQGSASNAMSNTPSHVLTAIGLSEAEARRTYRISLPPYKV
Ligand information
Ligand ID
CYS
InChI
InChI=1S/C3H7NO2S/c4-2(1-7)3(5)6/h2,7H,1,4H2,(H,5,6)/t2-/m0/s1
InChIKey
XUJNEKJLAYXESH-REOHCLBHSA-N
SMILES
Software
SMILES
CACTVS 3.341
N[CH](CS)C(O)=O
OpenEye OEToolkits 1.5.0
C([C@@H](C(=O)O)N)S
CACTVS 3.341
N[C@@H](CS)C(O)=O
ACDLabs 10.04
O=C(O)C(N)CS
OpenEye OEToolkits 1.5.0
C(C(C(=O)O)N)S
Formula
C3 H7 N O2 S
Name
CYSTEINE
ChEMBL
CHEMBL863
DrugBank
DB00151
ZINC
ZINC000000895042
PDB chain
6m4j Chain A Residue 402 [
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Receptor-Ligand Complex Structure
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PDB
6m4j
Structural Analysis of an l-Cysteine Desulfurase from an Ssp DNA Phosphorothioation System.
Resolution
1.8 Å
Binding residue
(original residue number in PDB)
A9 H99 N150 R340
Binding residue
(residue number reindexed from 1)
A8 H98 N149 R339
Annotation score
4
External links
PDB
RCSB:6m4j
,
PDBe:6m4j
,
PDBj:6m4j
PDBsum
6m4j
PubMed
32345643
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