2026-09-19_00000273
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ligand
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9ZB3
Crystal structure of human MGAT1 in complex with TNG-9333.;
X-ray diffraction 2.00Å
Protein #1
356 residues (93% resolved)
Raw Sequence ...
MHHHHHHENLYFQGAVIPILVIACDRSTVRRCLDKLLHYRPSAELFPIIVSQDCGHEETAQAIASYGSAVTHIRQPDLSSIAVPPDHRKFQGYYKIARHYRWALGQVFRQFRFPAAVVVEDDLEVAPDFFEYFRATYPLLKADPSLWCVSAWNDNGKEQMVDASRPELLYRTDFFPGLGWLLLAELWAELEPKWPKAFWDDWMRRPEQRQGRACIRPEISRTMTFGRKGVSHGQFFDQHLKFIKLNQQFVHFTQLDLSYLQREAYDRDFLARVYGAPQLQVEKVRTNDRKELGEVRVQYTGRDSFKAFAKALGVMDDLKSGVPRAGYRGIVTFQFRGRRVHLAPPLTWEGYDPSWN
Canonical Sequence ...
MHHHHHHENLYFQGAVIPILVIACDRSTVRRCLDKLLHYRPSAELFPIIVSQDCGHEETAQAIASYGSAVTHIRQPDLSSIAVPPDHRKFQGYYKIARHYRWALGQVFRQFRFPAAVVVEDDLEVAPDFFEYFRATYPLLKADPSLWCVSAWNDNGKEQMVDASRPELLYRTDFFPGLGWLLLAELWAELEPKWPKAFWDDWMRRPEQRQGRACIRPEISRTMTFGRKGVSHGQFFDQHLKFIKLNQQFVHFTQLDLSYLQREAYDRDFLARVYGAPQLQVEKVRTNDRKELGEVRVQYTGRDSFKAFAKALGVMDDLKSGVPRAGYRGIVTFQFRGRRVHLAPPLTWEGYDPSWN
Non polymer #2
A1C1W
InChI=1S/C23H25N5O3/c1-14(29)28(2)21-11-15(10-16(13-24)25-21)26-23(30)19-12-22(31-17-6-5-7-17)27-20-9-4-3-8-18(19)20/h3-4,8-12,17H,5-7,13,24H2,1-2H3,(H,25,26,30)
InChI=1S/C23H25N5O3/c1-14(29)28(2)21-11-15(10-16(13-24)25-21)26-23(30)19-12-22(31-17-6-5-7-17)27-20-9-4-3-8-18(19)20/h3-4,8-12,17H,5-7,13,24H2,1-2H3,(H,25,26,30)
SMILES: CC(=O)N(C)c1cc(cc(n1)CN)NC(=O)c2cc(nc3c2cccc3)OC4CCC4
CC(=O)N(C)c1cc(cc(n1)CN)NC(=O)c2cc(nc3c2cccc3)OC4CCC4
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
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Model
Reference
100%