2026-10-17_00000193
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ligand
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9TNH
Crystal structure of Mycobacterium abscessus Phosphopantetheine adenylyltransferase in complex with inhibitor;
X-ray diffraction 1.77Å
Protein #1
162 residues (97% resolved)
Raw Sequence ...
SMTGAVCPGSFDPVTLGHLDVFERAAAQFDEVIVAVLINPNKAGMFTVDERIEMIRESTADLPNLRVESGQGLLVDFVRERGLNAIVKGLRTGTDFEYELQMAQMNKHIAGVDTFFVATAPAYSFVSSSLAKEVATYGGDVSALLPASVHQRLLGKLRGQAQ
Canonical Sequence ...
SMTGAVCPGSFDPVTLGHLDVFERAAAQFDEVIVAVLINPNKAGMFTVDERIEMIRESTADLPNLRVESGQGLLVDFVRERGLNAIVKGLRTGTDFEYELQMAQMNKHIAGVDTFFVATAPAYSFVSSSLAKEVATYGGDVSALLPASVHQRLLGKLRGQAQ
Non polymer #2
A1JW5
InChI=1S/C18H15N3O2/c19-10-14-15(20)5-3-7-17(14)21-11-12(8-9-18(22)23)13-4-1-2-6-16(13)21/h1-7,11H,8-9,20H2,(H,22,23)
InChI=1S/C18H15N3O2/c19-10-14-15(20)5-3-7-17(14)21-11-12(8-9-18(22)23)13-4-1-2-6-16(13)21/h1-7,11H,8-9,20H2,(H,22,23)
SMILES: c1ccc2c(c1)c(cn2c3cccc(c3C#N)N)CCC(=O)O
c1ccc2c(c1)c(cn2c3cccc(c3C#N)N)CCC(=O)O
Biounit #1
homo-hexamer
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Model
Reference
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