2024-03-02_00000364

Protein #1 320 residues (90% resolved)

Raw Sequence ...

PQTEEVSIKEIAITHHVKEGHEKADPSQFELLKVLGQGSFGKVFLVKKISGSDARQLYAMKVLKKATLKVRDRVRTKMERDILVEVNHPFIVKLHYAFQTEGKLYLILDFLRGGDLFTRLSKEVMFTEEDVKFYLAELALALDHLHSLGIIYRDLKPENILLDEEGHIKLTDFGLSKESIDHEKKAYSFCGTVEYMAPEVVNRRGHTQSADWWSFGVLMFEMLTGTLPFQGKDRKETMTMILKAKLGMPQFLSPEAQSLLRMLFKRNPANRLGAGPDGVEEIKRHSFFSTIDWNKLYRREIHPPFKPATGRPEDTFYFDP

Canonical Sequence ...

Non polymer #2 A1LU8

InChI=1S/C21H18F2N2O2/c22-19-11-15(12-20(23)21(19)26)18-13-24-6-5-17(18)14-1-3-16(4-2-14)25-7-9-27-10-8-25/h1-6,11-13,26H,7-10H2

SMILES: c1cc(ccc1c2ccncc2c3cc(c(c(c3)F)O)F)N4CCOCC4

c1cc(ccc1c2ccncc2c3cc(c(c(c3)F)O)F)N4CCOCC4

2024-03-02_00000364|ligand|8XFY

Canonical Sequence ...

SMILES: c1cc(ccc1c2ccncc2c3cc(c(c(c3)F)O)F)N4CCOCC4