2026-08-15_00000068
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ligand
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36JC
Crystal structure of Yck2 from Candida albicans in complex with kinase inhibitor YK-1-55: 3-(2-aminopyridin-4-yl)-2-(4-fluorophenyl)pyrazolo[1,5-a]pyridine-6-carbonitrile;
X-ray diffraction 2.20Å
Protein #1
306 residues (100% resolved)
Raw Sequence ...
SSVVGLHYKIGKKIGEGSFGVIFEGTNIINGVPVAIKFEPRKTEAPQLRDEYRTYKHLQGCDGIPNAYYFGQEGLHNILVIDLLGPSLEDLFDWCGRRFSVKTVVQVAIQMLTLVEEVHRHDLIYRDIKPDNFLIGRRGATDENNVHLIDFGMAKQYRDPRTKQHIPYREKKSLSGTARYMSINTHLGREQSRRDDLEALGHVFFYFLRGQLPWQGLKAPTNKQKYEKIGDKKRTTPAVTLCDGLPQQFAEYLDSVRSLPFDAEPPYEEYRMLLLSVLDDLGQACDGDMDWMHLNGGRGWDATINK
Canonical Sequence ...
SSVVGLHYKIGKKIGEGSFGVIFEGTNIINGVPVAIKFEPRKTEAPQLRDEYRTYKHLQGCDGIPNAYYFGQEGLHNILVIDLLGPSLEDLFDWCGRRFSVKTVVQVAIQMLTLVEEVHRHDLIYRDIKPDNFLIGRRGATDENNVHLIDFGMAKQYRDPRTKQHIPYREKKSLSGTARYMSINTHLGREQSRRDDLEALGHVFFYFLRGQLPWQGLKAPTNKQKYEKIGDKKRTTPAVTLCDGLPQQFAEYLDSVRSLPFDAEPPYEEYRMLLLSVLDDLGQACDGDMDWMHLNGGRGWDATINK
Non polymer #2
A1DLN
InChI=1S/C19H12FN5/c20-15-4-2-13(3-5-15)19-18(14-7-8-23-17(22)9-14)16-6-1-12(10-21)11-25(16)24-19/h1-9,11H,(H2,22,23)
InChI=1S/C19H12FN5/c20-15-4-2-13(3-5-15)19-18(14-7-8-23-17(22)9-14)16-6-1-12(10-21)11-25(16)24-19/h1-9,11H,(H2,22,23)
SMILES: c1cc(ccc1c2c(c3ccc(cn3n2)C#N)c4ccnc(c4)N)F
c1cc(ccc1c2c(c3ccc(cn3n2)C#N)c4ccnc(c4)N)F
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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