2025-05-10_00000070|ligand|8ZEC

AtoB in complex with substrate analogue; X-ray diffraction 1.65Å
Protein #1 151 residues (97% resolved)

TDLMALPLRERLIQTADHYFRNMESFDLETGLTGRTADCILKVLPASFGMPDRTNEECMAAHIATRADMTMKNFKAWRVPGSIPIVDEANRKVVFHMEIYAEMGDGVYHNEFIFIMTTNDEGTLLKEVAEYVDTAAEKKFAAERMARTKGS

TDLMALPLRERLIQTADHYFRNMESFDLETGLTGRTADCILKVLPASFGMPDRTNEECMAAHIATRADMTMKNFKAWRVPGSIPIVDEANRKVVFHMEIYAEMGDGVYHNEFIFIMTTNDEGTLLKEVAEYVDTAAEKKFAAERMARTKGS
Non polymer #2 A1D8G

InChI=1S/C22H30O7/c1-10-7-8-22(26)20(4,5)17(23)16(29-22)18(24)21(6)14(10)9-13-15(28-21)11(2)12(3)27-19(13)25/h10,14,16,18,24,26H,7-9H2,1-6H3/t10-,14+,16+,18+,21-,22+/m0/s1

C[C@H]1CC[C@@]2(C(C(=O)[C@@H](O2)[C@H]([C@@]3([C@@H]1CC4=C(O3)C(=C(OC4=O)C)C)C)O)(C)C)O
Non polymer #3 CL

InChI=1S/ClH/h1H/p-1

[Cl-]
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