2026-07-11_00000150
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ligand
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9RUE
Crystal Structure of the VS1-bound StARD3 Lipid-Binding Domain;
X-ray diffraction 2.09Å
Protein #1
224 residues (96% resolved)
Raw Sequence ...
SDEEVAGKKSFSAQEREYIRQGKEATAVVDQILAQEENWKFEKNNEYGDTVYTIEVPFHGKTFILKTFLPCPAELVYQEVILQPERMVLWNKTVTACQILQRVEDNTLISYDVSAGAAGGVVSPRDFVNVRRIERRRDRYLSSGIATSHSAKPPTHKYVRGENGPGGFIVLKSASNPRVCTFVWILNTDLKGRLPRYLIHQSLAATMFEFAFHLRQRISELGAR
Canonical Sequence ...
SDEEVAGKKSFSAQEREYIRQGKEATAVVDQILAQEENWKFEKNNEYGDTVYTIEVPFHGKTFILKTFLPCPAELVYQEVILQPERMVLWNKTVTACQILQRVEDNTLISYDVSAGAAGGVVSPRDFVNVRRIERRRDRYLSSGIATSHSAKPPTHKYVRGENGPGGFIVLKSASNPRVCTFVWILNTDLKGRLPRYLIHQSLAATMFEFAFHLRQRISELGAR
Non polymer #2
A1JJL
InChI=1S/C22H20N4O4/c27-20-8-6-15(12-19(20)26(29)30)7-9-21-23-18-14-25(11-10-17(18)22(28)24-21)13-16-4-2-1-3-5-16/h1-9,12,27H,10-11,13-14H2,(H,23,24,28)/b9-7-
InChI=1S/C22H20N4O4/c27-20-8-6-15(12-19(20)26(29)30)7-9-21-23-18-14-25(11-10-17(18)22(28)24-21)13-16-4-2-1-3-5-16/h1-9,12,27H,10-11,13-14H2,(H,23,24,28)/b9-7-
SMILES: c1ccc(cc1)CN2CCC3=C(C2)N=C(NC3=O)/C=C\c4ccc(c(c4)[N+](=O)[O-])O
c1ccc(cc1)CN2CCC3=C(C2)N=C(NC3=O)/C=C\c4ccc(c(c4)[N+](=O)[O-])O
Non polymer #3
TLA
InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/m1/s1
InChI=1S/C4H6O6/c5-1(3(7)8)2(6)4(9)10/h1-2,5-6H,(H,7,8)(H,9,10)/t1-,2-/m1/s1
SMILES: [C@@H]([C@H](C(=O)O)O)(C(=O)O)O
[C@@H]([C@H](C(=O)O)O)(C(=O)O)O
Biounit #1
monomer
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Model
Reference
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