2026-02-28_00000188
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ligand
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9NEO
TEAD2 YAP binding domain (YBD);
X-ray diffraction 3.13Å
Protein #1
252 residues (79% resolved)
Raw Sequence ...
MGHHHHHHHHHHENLYFQGHMAWQARGLGTARLQLVEFSAFVEPPDAVDSYQRHLFVHISQHCPSPGAPPLESVDVRQIYDKFPEKKGGLRELYDRGPPHAFFLVKFWADLNWGPSGEEAGAGGSISSGGFYGVSSQYESLEHMTLTCSSKVCSFGKQVVEKVETERAQLEDGRFVYRLLRSPMCEYLVNFLHKLRQLPERYMMNSVLENFTILQVVTNRDTQELLLCTAYVFEVSTSERGAQHHIYRLVRD
Canonical Sequence ...
MGHHHHHHHHHHENLYFQGHMAWQARGLGTARLQLVEFSAFVEPPDAVDSYQRHLFVHISQHCPSPGAPPLESVDVRQIYDKFPEKKGGLRELYDRGPPHAFFLVKFWADLNWGPSGEEAGAGGSISSGGFYGVSSQYESLEHMTLTCSSKVCSFGKQVVEKVETERAQLEDGRFVYRLLRSPMCEYLVNFLHKLRQLPERYMMNSVLENFTILQVVTNRDTQELLLCTAYVFEVSTSERGAQHHIYRLVRD
Non polymer #2
A1BXX
InChI=1S/C20H16F3N5O2/c1-2-19(9-11-25-17(19)29)18-28-27-16(30-18)15-14(4-3-10-24-15)26-13-7-5-12(6-8-13)20(21,22)23/h2-8,10,26H,1,9,11H2,(H,25,29)/t19-/m1/s1
InChI=1S/C20H16F3N5O2/c1-2-19(9-11-25-17(19)29)18-28-27-16(30-18)15-14(4-3-10-24-15)26-13-7-5-12(6-8-13)20(21,22)23/h2-8,10,26H,1,9,11H2,(H,25,29)/t19-/m1/s1
SMILES: C=C[C@]1(CCNC1=O)c2nnc(o2)c3c(cccn3)Nc4ccc(cc4)C(F)(F)F
C=C[C@]1(CCNC1=O)c2nnc(o2)c3c(cccn3)Nc4ccc(cc4)C(F)(F)F
Biounit #1
homo-dimer
Download coordinates
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Model
Reference
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