2026-02-28_00000190
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ligand
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9NHG
E.coli DsbA in complex with N-(2-aminophenyl)-5-methylisoxazole-3-carboxamide;
X-ray diffraction 2.04Å
Protein #1
189 residues (99% resolved)
Raw Sequence ...
AQYEDGKQYTTLEKPVAGAPQVLEFFSFFCPHCYQFEEVLHISDNVKKKLPEGVKMTKYHVNFMGGDLGKDLTQAWAVAMALGVEDKVTVPLFEGVQKTQTIRSASDIRDVFINAGIKGEEYDAAWNSFVVKSLVAQQEKAAADVQLRGVPAMFVNGKYQLNPQGMDTSNMDVFVQQYADTVKYLSEKK
Canonical Sequence ...
AQYEDGKQYTTLEKPVAGAPQVLEFFSFFCPHCYQFEEVLHISDNVKKKLPEGVKMTKYHVNFMGGDLGKDLTQAWAVAMALGVEDKVTVPLFEGVQKTQTIRSASDIRDVFINAGIKGEEYDAAWNSFVVKSLVAQQEKAAADVQLRGVPAMFVNGKYQLNPQGMDTSNMDVFVQQYADTVKYLSEKK
Non polymer #2
A1BX8
InChI=1S/C11H11N3O2/c1-7-6-10(14-16-7)11(15)13-9-5-3-2-4-8(9)12/h2-6H,12H2,1H3,(H,13,15)
InChI=1S/C11H11N3O2/c1-7-6-10(14-16-7)11(15)13-9-5-3-2-4-8(9)12/h2-6H,12H2,1H3,(H,13,15)
SMILES: Cc1cc(no1)C(=O)Nc2ccccc2N
Cc1cc(no1)C(=O)Nc2ccccc2N
Non polymer #3
CU
InChI=1S/Cu/q+2
InChI=1S/Cu/q+2
SMILES: [Cu+2]
[Cu+2]
Biounit #1
homo-dimer
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Model
Reference
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