2026-06-13_00000175
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ligand
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9RFL
Human carbonic anhydrase II complexed with 2-(4-isobutylphenyl)-N-(2-sulfamoylethyl)propanamide;
X-ray diffraction 1.30Å
Protein #1
260 residues (99% resolved)
Raw Sequence ...
MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK
Canonical Sequence ...
MSHHWGYGKHNGPEHWHKDFPIAKGERQSPVDIDTHTAKYDPSLKPLSVSYDQATSLRILNNGHAFNVEFDDSQDKAVLKGGPLDGTYRLIQFHFHWGSLDGQGSEHTVDKKKYAAELHLVHWNTKYGDFGKAVQQPDGLAVLGIFLKVGSAKPGLQKVVDVLDSIKTKGKSADFTNFDPRGLLPESLDYWTYPGSLTTPPLLECVTWIVLKEPISVSSEQVLKFRKLNFNGEGEPEELMVDNWRPAQPLKNRQIKASFK
Non polymer #2
A1JFK
InChI=1S/C15H24N2O3S/c1-11(2)10-13-4-6-14(7-5-13)12(3)15(18)17-8-9-21(16,19)20/h4-7,11-12H,8-10H2,1-3H3,(H,17,18)(H2,16,19,20)/t12-/m1/s1
InChI=1S/C15H24N2O3S/c1-11(2)10-13-4-6-14(7-5-13)12(3)15(18)17-8-9-21(16,19)20/h4-7,11-12H,8-10H2,1-3H3,(H,17,18)(H2,16,19,20)/t12-/m1/s1
SMILES: C[C@H](c1ccc(cc1)CC(C)C)C(=O)NCCS(=O)(=O)N
C[C@H](c1ccc(cc1)CC(C)C)C(=O)NCCS(=O)(=O)N
Non polymer #3
EDO
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
InChI=1S/C2H6O2/c3-1-2-4/h3-4H,1-2H2
SMILES: C(CO)O
C(CO)O
Non polymer #4
ZN
InChI=1S/Zn/q+2
InChI=1S/Zn/q+2
SMILES: [Zn+2]
[Zn+2]
Biounit #1
monomer
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Model
Reference
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