2026-08-08_00000282
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ligand
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9WY5
Crystal Structure of HIF-PHD2 in complex with compound 3-13 (DS79540454);
X-ray diffraction 2.00Å
Protein #1
224 residues (99% resolved)
Raw Sequence ...
MAHHHHHHLPALKLALEYIVPCMNKHGICVVDDFLGKETGQQIGDEVRALHDTGKFTDGQLVSQKSDSSKDIRGDKITWIEGKEPGCETIGLLMSSMDDLIRHCNGKLGSYKINGRTKAMVACYPGNGTGYVRHVDNPNGDGRCVTCIYYLNKDWDAKVSGGILRIFPEGKAQFADIEPKFDRLLFFWSDRRNPHEVQPAYATRYAITVWYFDADERARAKVKY
Canonical Sequence ...
MAHHHHHHLPALKLALEYIVPCMNKHGICVVDDFLGKETGQQIGDEVRALHDTGKFTDGQLVSQKSDSSKDIRGDKITWIEGKEPGCETIGLLMSSMDDLIRHCNGKLGSYKINGRTKAMVACYPGNGTGYVRHVDNPNGDGRCVTCIYYLNKDWDAKVSGGILRIFPEGKAQFADIEPKFDRLLFFWSDRRNPHEVQPAYATRYAITVWYFDADERARAKVKY
Non polymer #2
A1MCE
InChI=1S/C22H20N4O5/c27-18(9-10-19(28)29)25-22-24-13-17(21(31)26-22)20(30)23-12-14-5-4-8-16(11-14)15-6-2-1-3-7-15/h1-8,11,13H,9-10,12H2,(H,23,30)(H,28,29)(H2,24,25,26,27,31)
InChI=1S/C22H20N4O5/c27-18(9-10-19(28)29)25-22-24-13-17(21(31)26-22)20(30)23-12-14-5-4-8-16(11-14)15-6-2-1-3-7-15/h1-8,11,13H,9-10,12H2,(H,23,30)(H,28,29)(H2,24,25,26,27,31)
SMILES: c1ccc(cc1)c2cccc(c2)CNC(=O)C3=CN=C(NC3=O)NC(=O)CCC(=O)O
c1ccc(cc1)c2cccc(c2)CNC(=O)C3=CN=C(NC3=O)NC(=O)CCC(=O)O
Non polymer #3
FE2
InChI=1S/Fe/q+2
InChI=1S/Fe/q+2
SMILES: [Fe+2]
[Fe+2]
Biounit #1
monomer
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Model
Reference
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