2024-04-13_00000298
|
ligand
|
9BCB
Crystal structure of human cellular retinol binding protein 3 in complex with C11 TopFluor MG;
X-ray diffraction 1.45Å
Protein #1
139 residues (99% resolved)
Raw Sequence ...
MPPNLTGYYRFVSQKNMEDYLQALNISLAVRKIALLLKPDKEIEHQGNHMTVRTLSTFRNYTVQFDVGVEFEEDLRSVDGRKCQTIVTWEEEHLVCVQKGEVPNRGWRHWLEGEMLYLELTARDAVCEQVFRKVRLVPR
Canonical Sequence ...
MPPNLTGYYRFVSQKNMEDYLQALNISLAVRKIALLLKPDKEIEHQGNHMTVRTLSTFRNYTVQFDVGVEFEEDLRSVDGRKCQTIVTWEEEHLVCVQKGEVPNRGWRHWLEGEMLYLELTARDAVCEQVFRKVRLVPR
Non polymer #2
A1ALJ
InChI=1S/C27H41BF2N2O4/c1-19-15-21(3)31-26(19)24(27-20(2)16-22(4)32(27)28(31,29)30)13-11-9-7-5-6-8-10-12-14-25(35)36-18-23(34)17-33/h15-16,23,33-34H,5-14,17-18H2,1-4H3/t23-/m0/s1
InChI=1S/C27H41BF2N2O4/c1-19-15-21(3)31-26(19)24(27-20(2)16-22(4)32(27)28(31,29)30)13-11-9-7-5-6-8-10-12-14-25(35)36-18-23(34)17-33/h15-16,23,33-34H,5-14,17-18H2,1-4H3/t23-/m0/s1
SMILES: B1(n2c(cc(c2C(=C3[N]1=C(C=C3C)C)CCCCCCCCCCC(=O)OC[C@H](CO)O)C)C)(F)F
B1(n2c(cc(c2C(=C3[N]1=C(C=C3C)C)CCCCCCCCCCC(=O)OC[C@H](CO)O)C)C)(F)F
Biounit #1
monomer
Download coordinates
Biounit #2
monomer
Download coordinates
Tube
Model
Reference
100%