2026-08-22_00000089
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ligand
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13UP
Orf9b homodimer in complex with fragment ZINC000001729552;
X-ray diffraction 1.47Å
Protein #1
97 residues (87% resolved)
Raw Sequence ...
MDPKISEMHPALRLVDPQIQLAVTRMENAVGRDQNNVGPKVYPIILRLGSPLSLNMARKTLNSLEDKAFQLTPIAVQMTKLATTEELPDEFVVVTVK
Canonical Sequence ...
MDPKISEMHPALRLVDPQIQLAVTRMENAVGRDQNNVGPKVYPIILRLGSPLSLNMARKTLNSLEDKAFQLTPIAVQMTKLATTEELPDEFVVVTVK
Non polymer #2
A1C1K
InChI=1S/C10H20N2O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H2
InChI=1S/C10H20N2O2S/c13-15(14,11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H2
SMILES: C1CCN(CC1)S(=O)(=O)N2CCCCC2
C1CCN(CC1)S(=O)(=O)N2CCCCC2
Non polymer #3
D10
InChI=1S/C10H22/c1-3-5-7-9-10-8-6-4-2/h3-10H2,1-2H3
InChI=1S/C10H22/c1-3-5-7-9-10-8-6-4-2/h3-10H2,1-2H3
SMILES: CCCCCCCCCC
CCCCCCCCCC
Non polymer #4
DMS
InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
InChI=1S/C2H6OS/c1-4(2)3/h1-2H3
SMILES: CS(=O)C
CS(=O)C
Biounit #1
homo-dimer
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Model
Reference
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