2025-04-12_00000211
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ligand
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9F8S
Crystal Structure of PhzA/B from Burkholderia cepacia R18194 in complex with (4-Chlorophenyl)[6-hydroxy-2-phenylbenzo[b]thiophen-3-yl]methanone;
X-ray diffraction 1.69Å
Protein #1
185 residues (83% resolved)
Raw Sequence ...
MGSSHHHHHHSSGLVPRGSHMSDVESLENTSENRAQVAARQHNRKIVEQYMHTRGEARLKRHLLFTEDGVGGLWTTDSGQPIAIRGREKLGEHAVWSLQCFPDWVWTDIQIFETQDPNWFWVECRGEGAIVFPGYPRGQYRNHFLHSFRFENGLIKEQREFMNPCEQFRSLGIEVPEVRRDGLPS
Canonical Sequence ...
MGSSHHHHHHSSGLVPRGSHMSDVESLENTSENRAQVAARQHNRKIVEQYMHTRGEARLKRHLLFTEDGVGGLWTTDSGQPIAIRGREKLGEHAVWSLQCFPDWVWTDIQIFETQDPNWFWVECRGEGAIVFPGYPRGQYRNHFLHSFRFENGLIKEQREFMNPCEQFRSLGIEVPEVRRDGLPS
Non polymer #2
A1IAM
InChI=1S/C21H13ClO2S/c22-15-8-6-13(7-9-15)20(24)19-17-11-10-16(23)12-18(17)25-21(19)14-4-2-1-3-5-14/h1-12,23H
InChI=1S/C21H13ClO2S/c22-15-8-6-13(7-9-15)20(24)19-17-11-10-16(23)12-18(17)25-21(19)14-4-2-1-3-5-14/h1-12,23H
SMILES: c1ccc(cc1)c2c(c3ccc(cc3s2)O)C(=O)c4ccc(cc4)Cl
c1ccc(cc1)c2c(c3ccc(cc3s2)O)C(=O)c4ccc(cc4)Cl
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
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