Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T99912 | Target Info | |||
| Target Name | Kynureninase (KYNU) | ||||
| Synonyms | L-kynurenine hydrolase; KYNU | ||||
| Target Type | Preclinical Target | ||||
| Gene Name | KYNU | ||||
| Biochemical Class | Carbon-carbon bonds hydrolase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | Pyridoxal phosphate | Ligand Info | |||
| Canonical SMILES | CC1=NC=C(C(=C1O)C=O)COP(=O)(O)O | ||||
| InChI | 1S/C8H10NO6P/c1-5-8(11)7(3-10)6(2-9-5)4-15-16(12,13)14/h2-3,11H,4H2,1H3,(H2,12,13,14) | ||||
| InChIKey | NGVDGCNFYWLIFO-UHFFFAOYSA-N | ||||
| PubChem Compound ID | 1051 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 3E9K Crystal structure of Homo sapiens kynureninase-3-hydroxyhippuric acid inhibitor complex | ||||||
| Method | X-ray diffraction | Resolution | 1.70 Å | Mutation | No | [1] |
| PDB Sequence |
LELPADTVQR
15 IAAELKCHPT25 DERVALHLDE35 EDKLRHFREF46 YIPKIQDLPP56 VDLSLVNKDE 66 NAIYFLGNSL76 GLQPKMVKTY86 LEEELDKWAK96 IAAYGHEVGK106 RPWITGDESI 116 VGLMKDIVGA126 NEKEIALMNA136 LTVNLHLLML146 SFFKPTPKRY156 KILLEAKAFP 166 SDHYAIESQL176 QLHGLNIEES186 MRMIKPREGE196 ETLRIEDILE206 VIEKEGDSIA 216 VILFSGVHFY226 TGQHFNIPAI236 TKAGQAKGCY246 VGFDLAHAVG256 NVELYLHDWG 266 VDFACWCSYK276 YLNAGAGGIA286 GAFIHEKHAH296 TIKPALVGWF306 GHELSTRFKM 316 DNKLQLIPGV326 CGFRISNPPI336 LLVCSLHASL346 EIFKQATMKA356 LRKKSVLLTG 366 YLEYLIKHNY376 GVVNIITPSH395 VEERGCQLTI405 TFSVPNKDVF415 QELEKRGVVC 425 DKRNPNGIRV435 APVPLYNSFH445 DVYKFTNLLT455 SILDS
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| PDB ID: 2HZP Crystal Structure of Homo Sapiens Kynureninase | ||||||
| Method | X-ray diffraction | Resolution | 2.00 Å | Mutation | Yes | [2] |
| PDB Sequence |
LELPADTVQR
15 IAAELKCHPT25 DERVALHLDE35 EDKLRHFREF46 YIPKIQDLPP56 VDLSLVNKDE 66 NAIYFLGNSL76 GLQPKMVKTY86 LEEELDKWAK96 IAAYGHEVGK106 RPWITGDESI 116 VGLMKDIVGA126 NEKEIALMNA136 LTVNLHLLML146 SFFKPTPKRY156 KILLEAKAFP 166 SDHYAIESQL176 QLHGLNIEES186 MRMIKPREGE196 ETLRIEDILE206 VIEKEGDSIA 216 VILFSGVHFY226 TGQHFNIPAI236 TKAGQAKGCY246 VGFDLAHAVG256 NVELYLHDWG 266 VDFACWCSYK276 YLNAGAGGIA286 GAFIHEKHAH296 TIKPALVGWF306 GHELSTRFKM 316 DNKLQLIPGV326 CGFRISNPPI336 LLVCSLHASL346 EIFKQATMKA356 LRKKSVLLTG 366 YLEYLIKHNY376 GKVVNIITPS394 HVEERGCQLT404 ITFSVPNKDV414 FQELEKRGVV 424 CDKRNPNGIR434 VAPVPLYNSF444 HDVYKFTNLL454 TSILDS
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Crystal structure of the Homo sapiens kynureninase-3-hydroxyhippuric acid inhibitor complex: insights into the molecular basis of kynureninase substrate specificity. J Med Chem. 2009 Jan 22;52(2):389-96. | ||||
| REF 2 | Crystal structure of Homo sapiens kynureninase. Biochemistry. 2007 Mar 13;46(10):2735-44. | ||||
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