2025-11-29_00000167|ligand|9OVF

Rubredoxin covalently linked to benzo-18-crown-6; X-ray diffraction 1.45Å
Protein #1 45 residues (100% resolved)

MQKYVCNVCGYEYDPAEHDNVPFDQLPDDWCCPVCGVSKDQFSPA

MQKYVCNVCGYEYDPAEHDNVPFDQLPDDWCCPVCGVSKDQFSPA
Non polymer #2 15P

InChI=1S/C69H140O35/c1-71-4-5-73-8-9-75-12-13-77-16-17-79-20-21-81-24-25-83-28-29-85-32-33-87-36-37-89-40-41-91-44-45-93-48-49-95-52-53-97-56-57-99-60-61-101-64-65-103-68-69-104-67-66-102-63-62-100-59-58-98-55-54-96-51-50-94-47-46-92-43-42-90-39-38-88-35-34-86-31-30-84-27-26-82-23-22-80-19-18-78-15-14-76-11-10-74-7-6-72-3-2-70/h70H,2-69H2,1H3

COCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCOCCO
Non polymer #3 A1CET

InChI=1S/C16H24O6S/c23-14-1-2-15-16(13-14)22-12-10-20-8-6-18-4-3-17-5-7-19-9-11-21-15/h1-2,13,23H,3-12H2

c1cc2c(cc1S)OCCOCCOCCOCCOCCO2
Non polymer #4 ACT

InChI=1S/C2H4O2/c1-2(3)4/h1H3,(H,3,4)/p-1

CC(=O)[O-]
Non polymer #5 FE

InChI=1S/Fe/q+3

[Fe+3]
Non polymer #6 NA

InChI=1S/Na/q+1

[Na+]
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Reference