Structure of PDB 4gvo Chain A Binding Site BS02

Receptor Information
>4gvo Chain A (length=236) Species: 169963 (Listeria monocytogenes EGD-e) [Search protein sequence] [Download receptor structure] [Download structure with residue number starting from 1] [View receptor structure]
VQTITVGTGTQFPNVCFLDENGKLTGYDVELVKEIDKRLPGYKFKFKTMD
FSNLLVSLGAGKVDIVAHQMEKSKEREKKFLFNDVAYNNFPLQLTVLDSN
NSINSTKDLAGKRVITSATSNGALVLKKINEEQGNNFEIAYEGQGSNDTA
NQLKTGRADATISTPFAVDFQNKTSAIKEKVVGDVLSNAKVYFMLGKDET
KLSKKVDEALQSIIDDGTLKKLSEKWLGADYSKEQY
Ligand information
Ligand IDCSX
InChIInChI=1S/C3H7NO3S/c4-2(1-8-7)3(5)6/h2,8H,1,4H2,(H,5,6)/t2-/m0/s1
InChIKeyBHLMCOCHAVMHLD-REOHCLBHSA-N
SMILES
SoftwareSMILES
CACTVS 3.341N[CH](C[SH]=O)C(O)=O
OpenEye OEToolkits 1.5.0C(C(C(=O)O)N)S=O
CACTVS 3.341N[C@@H](C[S@@H]=O)C(O)=O
OpenEye OEToolkits 1.5.0C([C@@H](C(=O)O)N)[S@H]=O
ACDLabs 10.04O=C(O)C(N)CS=O
FormulaC3 H7 N O3 S
NameS-OXY CYSTEINE
ChEMBL
DrugBankDB03382
ZINC
PDB chain4gvo Chain A Residue 704 [Download ligand structure] [Download structure with residue number starting from 1] [View ligand structure]
Receptor-Ligand Complex Structure
Global viewLocal viewStructure summary

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PDB4gvo Putative L-Cystine ABC transporter from Listeria monocytogenes
Resolution1.448 Å
Binding residue
(original residue number in PDB)		F45 F84 H101 Q102 E104 R109 F123 S153 N154
Binding residue
(residue number reindexed from 1)		F12 F51 H68 Q69 E71 R76 F90 S120 N121
Annotation score1
Enzymatic activity
Enzyme Commision number ?
External links