2026-08-29_00000236
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ligand
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9WGU
Crystal structure of Cbl-b bound to compound;
X-ray diffraction 1.95Å
Protein #1
388 residues (99% resolved)
Raw Sequence ...
AAADRRTVEKTWKLMDKVVRLCQNPKLQLKNSPPYILDILPDTYQHLRLILSKYDDNQKLAQLSENEYFKIYIDSLMKKSKRAIRLFKEGKERMYEEQSQDRRNLTKLSLIFSHMLAEIKAIFPNGQFQGDNFRITKADAAEFWRKFFGDKTIVPWKVFRQCLHEVHQISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWGSILRNWNFLAVTHPGYMAFLTYDEVKARLQKYSTKPGSYIFRLSCTRLGQWAIGYVTGDGNILQTIPHNKPLFQALIDGSREGFYLYPDGRSYNPDLTGLCEPTPHDHIKVTQEQYELYCEMGSTFQLCKICAENDKDVKIEPCGHLMCTSCLTAWQESDGQGCPFCRCEIKGTEPIIVDPF
Canonical Sequence ...
AAADRRTVEKTWKLMDKVVRLCQNPKLQLKNSPPYILDILPDTYQHLRLILSKYDDNQKLAQLSENEYFKIYIDSLMKKSKRAIRLFKEGKERMYEEQSQDRRNLTKLSLIFSHMLAEIKAIFPNGQFQGDNFRITKADAAEFWRKFFGDKTIVPWKVFRQCLHEVHQISSGLEAMALKSTIDLTCNDYISVFEFDIFTRLFQPWGSILRNWNFLAVTHPGYMAFLTYDEVKARLQKYSTKPGSYIFRLSCTRLGQWAIGYVTGDGNILQTIPHNKPLFQALIDGSREGFYLYPDGRSYNPDLTGLCEPTPHDHIKVTQEQYELYCEMGSTFQLCKICAENDKDVKIEPCGHLMCTSCLTAWQESDGQGCPFCRCEIKGTEPIIVDPF
Non polymer #2
A1EWZ
InChI=1S/C31H36F3N5O/c1-20-6-5-10-38(17-20)18-22-12-26-25(27(13-22)31(32,33)34)9-11-39(28(26)40)24-8-4-7-23(14-24)30(15-21(2)16-30)29-36-35-19-37(29)3/h4,7-8,12-14,19-21H,5-6,9-11,15-18H2,1-3H3/t20-,21-,30+/m0/s1
InChI=1S/C31H36F3N5O/c1-20-6-5-10-38(17-20)18-22-12-26-25(27(13-22)31(32,33)34)9-11-39(28(26)40)24-8-4-7-23(14-24)30(15-21(2)16-30)29-36-35-19-37(29)3/h4,7-8,12-14,19-21H,5-6,9-11,15-18H2,1-3H3/t20-,21-,30+/m0/s1
SMILES: C[C@H]1CCCN(C1)Cc2cc3c(c(c2)C(F)(F)F)CCN(C3=O)c4cccc(c4)C5(CC(C5)C)c6nncn6C
C[C@H]1CCCN(C1)Cc2cc3c(c(c2)C(F)(F)F)CCN(C3=O)c4cccc(c4)C5(CC(C5)C)c6nncn6C
Non polymer #3
CA
InChI=1S/Ca/q+2
InChI=1S/Ca/q+2
SMILES: [Ca+2]
[Ca+2]
Non polymer #4
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
Non polymer #5
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
homo-dimer
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Model
Reference
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