2025-06-28_00000248|ligand|9OU1

Crystal structure of maize AKR4C13 in P21 space group; X-ray diffraction 1.45Å
Protein #1 327 residues (94% resolved)

MASAQAVGQGERGHFVLKSGHTIPAVGLGTWRAGSDTAHSVRTAIAEAGYRHVDTAAQYGVEKEVGRGLKAAMEGGINRKDLFVTSKLWCTELAPDRVRPALEKTLKDLQLDYLDLYLIHWPFRLKDGAHMPPEAGEVLELDMEGVWREMEGLVKDGLVKDIGVCNYTVAKLNRLMRSANVPPAVCQMEMHPGWKNDRIFEACKKHGIHVTAYSPLGSSEKNLAHDPLVEKVANKLDKTPGQVLLRWALQRGTSVIPKSTRDERIKENIQVFGWEIPEEDFRAL(CSO)GIKDEKRVLTGEELFVNKTHGPYKSATEVWDHEDLEHHHHHH

MASAQAVGQGERGHFVLKSGHTIPAVGLGTWRAGSDTAHSVRTAIAEAGYRHVDTAAQYGVEKEVGRGLKAAMEGGINRKDLFVTSKLWCTELAPDRVRPALEKTLKDLQLDYLDLYLIHWPFRLKDGAHMPPEAGEVLELDMEGVWREMEGLVKDGLVKDIGVCNYTVAKLNRLMRSANVPPAVCQMEMHPGWKNDRIFEACKKHGIHVTAYSPLGSSEKNLAHDPLVEKVANKLDKTPGQVLLRWALQRGTSVIPKSTRDERIKENIQVFGWEIPEEDFRALCGIKDEKRVLTGEELFVNKTHGPYKSATEVWDHEDLEHHHHHH
Non polymer #2 EDO

InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2

C(CO)O
Non polymer #3 NAP

InChI=1S/C21H28N7O17P3/c22-17-12-19(25-7-24-17)28(8-26-12)21-16(44-46(33,34)35)14(30)11(43-21)6-41-48(38,39)45-47(36,37)40-5-10-13(29)15(31)20(42-10)27-3-1-2-9(4-27)18(23)32/h1-4,7-8,10-11,13-16,20-21,29-31H,5-6H2,(H7-,22,23,24,25,32,33,34,35,36,37,38,39)/t10-,11-,13-,14-,15-,16-,20-,21-/m1/s1

c1cc(c[n+](c1)[C@H]2[C@@H]([C@@H]([C@H](O2)CO[P@@](=O)([O-])O[P@](=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)OP(=O)(O)O)O)O)O)C(=O)N
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Reference