Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T89873 | Target Info | |||
| Target Name | Ferritin (FTH1) | ||||
| Synonyms | PIG15; OK/SW-cl.84; Ferritin heavy chain; Ferritin H subunit; FTHL6; FTH; Cell proliferationinducing gene 15 protein; Cell proliferation-inducing gene 15 protein | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | FTH1 | ||||
| Biochemical Class | Metal ion oxidoreductase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | N~2~,N~5~-dihydroxyfuran-2,5-dicarboxamide | Ligand Info | |||
| Canonical SMILES | C1=C(OC(=C1)C(=O)NO)C(=O)NO | ||||
| InChI | 1S/C6H6N2O5/c9-5(7-11)3-1-2-4(13-3)6(10)8-12/h1-2,11-12H,(H,7,9)(H,8,10) | ||||
| InChIKey | PJWJTAUUGOFUIE-UHFFFAOYSA-N | ||||
| PubChem Compound ID | 4067148 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 7JGK Crystal Structure of the Ni-bound Human Heavy-chain variant 122H-delta C-star with 2,5-furandihyrdoxamate collected at 100K | ||||||
| Method | X-ray diffraction | Resolution | 2.68 Å | Mutation | Yes | [1] |
| PDB Sequence |
TSQVRQNYHQ
14 DSEAAINRQI24 NLELYASYVY34 LSMSYYFDRD44 DVALKNFAKY54 FLHQSHEERE 64 HAEKLMKLQN74 QRGGRIFLQD84 IQKPDEDDWE94 SGLNAMEAAL104 HLEKNVNQSL 114 LELHKLAHDK124 NDPHLADFIE134 THYLNEQVKA144 IKELGDHVTN154 LRKMGAPESG 164 LAEYLFDKHT174 LGDS
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| PDB ID: 7JGQ Crystal Structure of the Ni-bound Human Heavy-chain variant 122H-delta C-star with 2,5-furandihyrdoxamate collected at 278K after one heating/cooling cycle | ||||||
| Method | X-ray diffraction | Resolution | 3.01 Å | Mutation | Yes | [1] |
| PDB Sequence |
TSQVRQNYHQ
14 DSEAAINRQI24 NLELYASYVY34 LSMSYYFDRD44 DVALKNFAKY54 FLHQSHEERE 64 HAEKLMKLQN74 QRGGRIFLQD84 IQKPDEDDWE94 SGLNAMEAAL104 HLEKNVNQSL 114 LELHKLAHDK124 NDPHLADFIE134 THYLNEQVKA144 IKELGDHVTN154 LRKMGAPESG 164 LAEYLFDKHT174 LGD
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| PDB ID: 7JGO Crystal Structure of the Ni-bound Human Heavy-chain variant 122H-delta C-star with 2,5-furandihyrdoxamate collected at 278K | ||||||
| Method | X-ray diffraction | Resolution | 3.08 Å | Mutation | Yes | [1] |
| PDB Sequence |
TSQVRQNYHQ
14 DSEAAINRQI24 NLELYASYVY34 LSMSYYFDRD44 DVALKNFAKY54 FLHQSHEERE 64 HAEKLMKLQN74 QRGGRIFLQD84 IQKPDEDDWE94 SGLNAMEAAL104 HLEKNVNQSL 114 LELHKLAHDK124 NDPHLADFIE134 THYLNEQVKA144 IKELGDHVTN154 LRKMGAPESG 164 LAEYLFDKHT174 LGD
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Tunable and Cooperative Thermomechanical Properties of Protein-Metal-Organic Frameworks. J Am Chem Soc. 2020 Oct 14;142(41):17265-17270. | ||||
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