2026-05-16_00000287
|
ligand
|
9R56
Wee1-like kinase in complex wirh MIPS-54861;
X-ray diffraction 3.01Å
Protein #1
288 residues (91% resolved)
Raw Sequence ...
GAMGKSRYTTEFHELEKIGSGEFGSVFKCVKRLDGCIYAIKRSKKPLAGSVDEQNALREVYAHAVLGQHSHVVRYFSAWAEDDHMLIQNEYCNGGSLADAISENYRIMSYFKEAELKDLLLQVGRGLRYIHSMSLVHMDIKPSNIFISRTSIPNAASEEGDEDDWASNKVMFKIGDLGHVTRISSPQVEEGDSRFLANEVLQENYTHLPKADIFALALTVVCAAGAEPLPRNGDQWHEIRQGRLPRIPQVLSQEFTELLKVMIHPDPERRPSAMALVKHSVLLSASRK
Canonical Sequence ...
GAMGKSRYTTEFHELEKIGSGEFGSVFKCVKRLDGCIYAIKRSKKPLAGSVDEQNALREVYAHAVLGQHSHVVRYFSAWAEDDHMLIQNEYCNGGSLADAISENYRIMSYFKEAELKDLLLQVGRGLRYIHSMSLVHMDIKPSNIFISRTSIPNAASEEGDEDDWASNKVMFKIGDLGHVTRISSPQVEEGDSRFLANEVLQENYTHLPKADIFALALTVVCAAGAEPLPRNGDQWHEIRQGRLPRIPQVLSQEFTELLKVMIHPDPERRPSAMALVKHSVLLSASRK
Non polymer #2
A1JDC
InChI=1S/C30H34N8O3/c1-3-9-37-28(39)23-17-31-29-32-22-5-6-24(36-12-10-35(2)11-13-36)21(16-22)19-41-18-20-14-25(30(40)7-4-8-30)33-26(15-20)38(37)27(23)34-29/h3,5-6,14-17,40H,1,4,7-13,18-19H2,2H3,(H,31,32,34)
InChI=1S/C30H34N8O3/c1-3-9-37-28(39)23-17-31-29-32-22-5-6-24(36-12-10-35(2)11-13-36)21(16-22)19-41-18-20-14-25(30(40)7-4-8-30)33-26(15-20)38(37)27(23)34-29/h3,5-6,14-17,40H,1,4,7-13,18-19H2,2H3,(H,31,32,34)
SMILES: CN1CCN(CC1)c2ccc3cc2COCc4cc(nc(c4)N5c6c(cnc(n6)N3)C(=O)N5CC=C)C7(CCC7)O
CN1CCN(CC1)c2ccc3cc2COCc4cc(nc(c4)N5c6c(cnc(n6)N3)C(=O)N5CC=C)C7(CCC7)O
Non polymer #3
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
Tube
Model
Reference
100%