Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T25703 | Target Info | |||
| Target Name | Heme oxygenase 1 (HMOX1) | ||||
| Synonyms | HO1; HO-1; HO | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | HMOX1 | ||||
| Biochemical Class | Paired donor oxygen oxidoreductase | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | Iron-octaethylporphyrin | Ligand Info | |||
| Canonical SMILES | CC1=CC2=CC3=C(C(=C([N-]3)C=C4C(=C(C(=N4)[O+]=C5C(=C(C(=CC1=N2)[N-]5)C)C=C)C)C=C)C)CCC(=O)O.[Fe] | ||||
| InChI | 1S/C30H28N4O3.Fe/c1-7-20-18(6)29-34-27(20)14-24-17(5)22(9-10-28(35)36)26(32-24)12-19-11-15(3)23(31-19)13-25-16(4)21(8-2)30(33-25)37-29;/h7-8,11-14H,1-2,9-10H2,3-6H3,(H2-,31,32,33,34,35,36);/p-1 | ||||
| InChIKey | YNRBZLYCQMZTKG-UHFFFAOYSA-M | ||||
| PubChem Compound ID | 137350119 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 1TWR Crystal structures of ferrous and ferrous-NO forms of verdoheme in a complex with human heme oxygenase-1: catalytic implications for heme cleavage | ||||||
| Method | X-ray diffraction | Resolution | 2.10 Å | Mutation | No | [1] |
| PDB Sequence |
PQDLSEALKE
19 ATKEVHTQAE29 NAEFMRNFQK39 GQVTRDGFKL49 VMASLYHIYV59 ALEEEIERNK 69 ESPVFAPVYF79 PEELHRKAAL89 EQDLAFWYGP99 RWQEVIPYTP109 AMQRYVKRLH 119 EVGRTEPELL129 VAHAYTRYLG139 DLSGGQVLKK149 IAQKALDLPS159 SGEGLAFFTF 169 PNIASATKFK179 QLYRSRMNSL189 EMTPAVRQRV199 IEEAKTAFLL209 NIQLFEELQE 219 LLTH
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| PDB ID: 1TWN Crystal structures of ferrous and ferrous-NO forms of verdoheme in a complex with human heme oxygenase-1: catalytic implications for heme cleavage | ||||||
| Method | X-ray diffraction | Resolution | 2.20 Å | Mutation | No | [1] |
| PDB Sequence |
PQDLSEALKE
19 ATKEVHTQAE29 NAEFMRNFQK39 GQVTRDGFKL49 VMASLYHIYV59 ALEEEIERNK 69 ESPVFAPVYF79 PEELHRKAAL89 EQDLAFWYGP99 RWQEVIPYTP109 AMQRYVKRLH 119 EVGRTEPELL129 VAHAYTRYLG139 DLSGGQVLKK149 IAQKALDLPS159 SGEGLAFFTF 169 PNIASATKFK179 QLYRSRMNSL189 EMTPAVRQRV199 IEEAKTAFLL209 NIQLFEELQE 219 LLTH
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Crystal structures of ferrous and ferrous-NO forms of verdoheme in a complex with human heme oxygenase-1: catalytic implications for heme cleavage. J Inorg Biochem. 2004 Nov;98(11):1686-95. | ||||
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