Structure of PDB 4ct3 Chain C Binding Site BS01
Receptor Information
>4ct3 Chain C (length=163) [
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AKTQAEINKRLDAYAKGTVDSPYRVKKATSYDPSFGVMEAGAIDADGYYH
AQQDLITDYVLWLTDNKVRTWGNAKDQIKQSYGTGFKIHENKPSTVPKKG
WIAVFTSGSYEQWGHIGIVYDGGNTSTFTILEQNWNGYANKKPTKRVDNY
YGLTHFIEIPVKA
Ligand information
Ligand ID
CMH
InChI
InChI=1S/C3H7NO2S.CH3.Hg/c4-2(1-7)3(5)6;;/h2,7H,1,4H2,(H,5,6);1H3;/q;;+1/p-1/t2-;;/m0../s1
InChIKey
OMYFBIZVJYGJJA-JIZZDEOASA-M
SMILES
Software
SMILES
CACTVS 3.341
C[Hg]SC[C@H](N)C(O)=O
CACTVS 3.341
C[Hg]SC[CH](N)C(O)=O
OpenEye OEToolkits 1.5.0
C[Hg]SC[C@@H](C(=O)O)N
ACDLabs 10.04
O=C(O)C(N)CS[Hg]C
OpenEye OEToolkits 1.5.0
C[Hg]SCC(C(=O)O)N
Formula
C4 H9 Hg N O2 S
Name
S-(METHYLMERCURY)-L-CYSTEINE
ChEMBL
DrugBank
ZINC
PDB chain
4ct3 Chain C Residue 1166 [
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Receptor-Ligand Complex Structure
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PDB
4ct3
Crystal structure of the lytic CHAP(K) domain of the endolysin LysK from Staphylococcus aureus bacteriophage K.
Resolution
1.69 Å
Binding residue
(original residue number in PDB)
Q53 Q55 D56 L57 H117 I118 Q135
Binding residue
(residue number reindexed from 1)
Q52 Q53 D54 L55 H115 I116 Q133
Annotation score
1
Enzymatic activity
Enzyme Commision number
?
External links
PDB
RCSB:4ct3
,
PDBe:4ct3
,
PDBj:4ct3
PDBsum
4ct3
PubMed
25064136
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