2026-09-12_00000103
|
ligand
|
35UC
Crystal structure of 2-amino-[1,2,4]triazolo[1,5-a]pyridine derivative bound to KIT;
X-ray diffraction 2.33Å
Protein #1
339 residues (93% resolved)
Raw Sequence ...
GPMDPTYKYLQKPMYEVQWKVVEEINGNNYVYIDPTQLPYDHKWEFPRNRLSFGKTLGAGAFGKVVEATAYGLIKSDAAMTVAVKMLKPSAHLTEREALMSELKVLSYLGNHMNIVNLLGACTIGGPTLVITEYCCYGDLLNFLRRKRDSFICSKTSPAIMEDDELALDLEDLLSFSYQVAKGMAFLASKNCIHRDLAARNILLTHGRITKICDFGLARDIKNDSNYVVKGNARLPVKWMAPESIFNCVYTFESDVWSYGIFLWELFSLGSSPYPGMPVDSKFYKMIKEGFRMLSPEHAPAEMYDIMKTCWDADPLKRPTFKQIVQLIEKQISESTNHI
Canonical Sequence ...
GPMDPTYKYLQKPMYEVQWKVVEEINGNNYVYIDPTQLPYDHKWEFPRNRLSFGKTLGAGAFGKVVEATAYGLIKSDAAMTVAVKMLKPSAHLTEREALMSELKVLSYLGNHMNIVNLLGACTIGGPTLVITEYCCYGDLLNFLRRKRDSFICSKTSPAIMEDDELALDLEDLLSFSYQVAKGMAFLASKNCIHRDLAARNILLTHGRITKICDFGLARDIKNDSNYVVKGNARLPVKWMAPESIFNCVYTFESDVWSYGIFLWELFSLGSSPYPGMPVDSKFYKMIKEGFRMLSPEHAPAEMYDIMKTCWDADPLKRPTFKQIVQLIEKQISESTNHI
Non polymer #2
A1DMF
InChI=1S/C18H16FN7O/c1-11-2-3-15(14(19)6-11)22-17(27)10-25-9-13(8-21-25)12-4-5-26-16(7-12)23-18(20)24-26/h2-9H,10H2,1H3,(H2,20,24)(H,22,27)
InChI=1S/C18H16FN7O/c1-11-2-3-15(14(19)6-11)22-17(27)10-25-9-13(8-21-25)12-4-5-26-16(7-12)23-18(20)24-26/h2-9H,10H2,1H3,(H2,20,24)(H,22,27)
SMILES: Cc1ccc(c(c1)F)NC(=O)Cn2cc(cn2)c3ccn4c(c3)nc(n4)N
Cc1ccc(c(c1)F)NC(=O)Cn2cc(cn2)c3ccn4c(c3)nc(n4)N
Biounit #1
monomer
Download coordinates
Tube
Model
Reference
100%