2026-03-21_00000126
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ligand
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9PRH
Crystal structure of E.coli DsbA in-complex with analogue 8;
X-ray diffraction 2.08Å
Protein #1
188 residues (100% resolved)
Raw Sequence ...
AQYEDGKQYTTLEKPVAGAPQVLEFFSFFCPHCYQFEEVLHISDNVKKKLPEGVKMTKYHVNFMGGDLGKDLTQAWAVAMALGVEDKVTVPLFEGVQKTQTIRSASDIRDVFINAGIKGEEYDAAWNSFVVKSLVAQQEKAAADVQLRGVPAMFVNGKYQLNPQGMDTSNMDVFVQQYADTVKYLSEK
Canonical Sequence ...
AQYEDGKQYTTLEKPVAGAPQVLEFFSFFCPHCYQFEEVLHISDNVKKKLPEGVKMTKYHVNFMGGDLGKDLTQAWAVAMALGVEDKVTVPLFEGVQKTQTIRSASDIRDVFINAGIKGEEYDAAWNSFVVKSLVAQQEKAAADVQLRGVPAMFVNGKYQLNPQGMDTSNMDVFVQQYADTVKYLSEK
Non polymer #2
A1CJL
InChI=1S/C17H17N3O5/c1-11-7-15(20-25-11)17(24)19-13-4-2-3-12(8-13)5-6-16(23)18-9-14(22)10-21/h2-4,7-8,14,21-22H,9-10H2,1H3,(H,18,23)(H,19,24)/t14-/m1/s1
InChI=1S/C17H17N3O5/c1-11-7-15(20-25-11)17(24)19-13-4-2-3-12(8-13)5-6-16(23)18-9-14(22)10-21/h2-4,7-8,14,21-22H,9-10H2,1H3,(H,18,23)(H,19,24)/t14-/m1/s1
SMILES: Cc1cc(no1)C(=O)Nc2cccc(c2)C#CC(=O)NC[C@H](CO)O
Cc1cc(no1)C(=O)Nc2cccc(c2)C#CC(=O)NC[C@H](CO)O
Biounit #1
monomer
Download coordinates
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Model
Reference
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