2026-08-15_00000071
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ligand
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36JF
Crystal structure of Yck2 from Candida albicans in complex with kinase inhibitor MN-II-74: 4-(2-(4-fluorophenyl)-6-methylpyrazolo[1,5-a]pyridin-3-yl)pyridin-2-amine;
X-ray diffraction 2.30Å
Protein #1
306 residues (100% resolved)
Raw Sequence ...
SSVVGLHYKIGKKIGEGSFGVIFEGTNIINGVPVAIKFEPRKTEAPQLRDEYRTYKHLQGCDGIPNAYYFGQEGLHNILVIDLLGPSLEDLFDWCGRRFSVKTVVQVAIQMLTLVEEVHRHDLIYRDIKPDNFLIGRRGATDENNVHLIDFGMAKQYRDPRTKQHIPYREKKSLSGTARYMSINTHLGREQSRRDDLEALGHVFFYFLRGQLPWQGLKAPTNKQKYEKIGDKKRTTPAVTLCDGLPQQFAEYLDSVRSLPFDAEPPYEEYRMLLLSVLDDLGQACDGDMDWMHLNGGRGWDATINK
Canonical Sequence ...
SSVVGLHYKIGKKIGEGSFGVIFEGTNIINGVPVAIKFEPRKTEAPQLRDEYRTYKHLQGCDGIPNAYYFGQEGLHNILVIDLLGPSLEDLFDWCGRRFSVKTVVQVAIQMLTLVEEVHRHDLIYRDIKPDNFLIGRRGATDENNVHLIDFGMAKQYRDPRTKQHIPYREKKSLSGTARYMSINTHLGREQSRRDDLEALGHVFFYFLRGQLPWQGLKAPTNKQKYEKIGDKKRTTPAVTLCDGLPQQFAEYLDSVRSLPFDAEPPYEEYRMLLLSVLDDLGQACDGDMDWMHLNGGRGWDATINK
Non polymer #2
A1DLQ
InChI=1S/C19H15FN4/c1-12-2-7-16-18(14-8-9-22-17(21)10-14)19(23-24(16)11-12)13-3-5-15(20)6-4-13/h2-11H,1H3,(H2,21,22)
InChI=1S/C19H15FN4/c1-12-2-7-16-18(14-8-9-22-17(21)10-14)19(23-24(16)11-12)13-3-5-15(20)6-4-13/h2-11H,1H3,(H2,21,22)
SMILES: Cc1ccc2c(c(nn2c1)c3ccc(cc3)F)c4ccnc(c4)N
Cc1ccc2c(c(nn2c1)c3ccc(cc3)F)c4ccnc(c4)N
Non polymer #3
CL
InChI=1S/ClH/h1H/p-1
InChI=1S/ClH/h1H/p-1
SMILES: [Cl-]
[Cl-]
Biounit #1
monomer
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Model
Reference
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