2026-10-17_00000182
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ligand
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9T60
Crystal structure of Mycobacterium abscessus Phosphopantetheine adenylyltransferase in complex with inhibitor;
X-ray diffraction 1.40Å
Protein #1
162 residues (97% resolved)
Raw Sequence ...
SMTGAVCPGSFDPVTLGHLDVFERAAAQFDEVIVAVLINPNKAGMFTVDERIEMIRESTADLPNLRVESGQGLLVDFVRERGLNAIVKGLRTGTDFEYELQMAQMNKHIAGVDTFFVATAPAYSFVSSSLAKEVATYGGDVSALLPASVHQRLLGKLRGQAQ
Canonical Sequence ...
SMTGAVCPGSFDPVTLGHLDVFERAAAQFDEVIVAVLINPNKAGMFTVDERIEMIRESTADLPNLRVESGQGLLVDFVRERGLNAIVKGLRTGTDFEYELQMAQMNKHIAGVDTFFVATAPAYSFVSSSLAKEVATYGGDVSALLPASVHQRLLGKLRGQAQ
Non polymer #2
A1JT0
InChI=1S/C25H24N2O4S/c1-19-17-27(24-10-6-5-9-23(19)24)16-15-25(28)26-32(29,30)22-13-11-21(12-14-22)31-18-20-7-3-2-4-8-20/h2-14,17H,15-16,18H2,1H3,(H,26,28)
InChI=1S/C25H24N2O4S/c1-19-17-27(24-10-6-5-9-23(19)24)16-15-25(28)26-32(29,30)22-13-11-21(12-14-22)31-18-20-7-3-2-4-8-20/h2-14,17H,15-16,18H2,1H3,(H,26,28)
SMILES: Cc1cn(c2c1cccc2)CCC(=O)NS(=O)(=O)c3ccc(cc3)OCc4ccccc4
Cc1cn(c2c1cccc2)CCC(=O)NS(=O)(=O)c3ccc(cc3)OCc4ccccc4
Biounit #1
homo-hexamer
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Model
Reference
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