Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T01521 | Target Info | |||
| Target Name | Glutathione S-transferase omega-1 (GSTO-1) | ||||
| Synonyms | SPG-R; S-(Phenacyl)glutathione reductase; Monomethylarsonic acid reductase; MMA(V) reductase; Glutathione-dependent dehydroascorbate reductase; Glutathione S-transferase omega 1-1; GSTTLP28; GSTO-1; GSTO 1-1 | ||||
| Target Type | Preclinical Target | ||||
| Gene Name | GSTO1 | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | Glutathione | Ligand Info | |||
| Canonical SMILES | C(CC(=O)NC(CS)C(=O)NCC(=O)O)C(C(=O)O)N | ||||
| InChI | 1S/C10H17N3O6S/c11-5(10(18)19)1-2-7(14)13-6(4-20)9(17)12-3-8(15)16/h5-6,20H,1-4,11H2,(H,12,17)(H,13,14)(H,15,16)(H,18,19)/t5-,6-/m0/s1 | ||||
| InChIKey | RWSXRVCMGQZWBV-WDSKDSINSA-N | ||||
| PubChem Compound ID | 124886 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 5YVN Human Glutathione Transferase Omega1 | ||||||
| Method | X-ray diffraction | Resolution | 1.33 Å | Mutation | No | [1] |
| PDB Sequence |
ESARSLGKGS
13 APPGPVPEGS23 IRIYSMRFCP33 FAERTRLVLK43 AKGIRHEVIN53 INLKNKPEWF 63 FKKNPFGLVP73 VLENSQGQLI83 YESAITCEYL93 DEAYPGKKLL103 PDDPYEKACQ 113 KMILELFSKV123 PSLVGSFIRS133 QNKEDYAGLK143 EEFRKEFTKL153 EEVLTNKKTT 163 FFGGNSISMI173 DYLIWPWFER183 LEAMKLNECV193 DHTPKLKLWM203 AAMKEDPTVS 213 ALLTSEKDWQ223 GFLELYLQNS233 PEACDYGL
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| PDB ID: 1EEM GLUTATHIONE TRANSFERASE FROM HOMO SAPIENS | ||||||
| Method | X-ray diffraction | Resolution | 2.00 Å | Mutation | No | [2] |
| PDB Sequence |
SARSLGKGSA
14 PPGPVPEGSI24 RIYSMRFCPF34 AERTRLVLKA44 KGIRHEVINI54 NLKNKPEWFF 64 KKNPFGLVPV74 LENSQGQLIY84 ESAITCEYLD94 EAYPGKKLLP104 DDPYEKACQK 114 MILELFSKVP124 SLVGSFIRSQ134 NKEDYAGLKE144 EFRKEFTKLE154 EVLTNKKTTF 164 FGGNSISMID174 YLIWPWFERL184 EAMKLNECVD194 HTPKLKLWMA204 AMKEDPTVSA 214 LLTSEKDWQG224 FLELYLQNSP234 EACDYGL
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| PDB ID: 3LFL Crystal Structure of human Glutathione Transferase Omega 1, delta 155 | ||||||
| Method | X-ray diffraction | Resolution | 2.10 Å | Mutation | No | [3] |
| PDB Sequence |
SARSLGKGSA
14 PPGPVPEGSI24 RIYSMRFCPF34 AERTRLVLKA44 KGIRHEVINI54 NLKNKPEWFF 64 KKNPFGLVPV74 LENSQGQLIY84 ESAITCEYLD94 EAYPGKKLLP104 DDPYEKACQK 114 MILELFSKVP124 SLVGSFIRSQ134 NKEDYAGLKE144 EFRKEFTKLE154 VLTNKKTTFF 164 GGNSISMIDY174 LIWPWFERLE184 AMKLNECVDH194 TPKLKLWMAA204 MKEDPTVSAL 214 LTSEKDWQGF224 LELYLQNSPE234 ACDYGL
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Glutathione transferase Omega 1-1 (GSTO1-1) modulates Akt and MEK1/2 signaling in human neuroblastoma cell SH-SY5Y. Proteins. 2019 Jul;87(7):588-595. | ||||
| REF 2 | Identification, characterization, and crystal structure of the Omega class glutathione transferases. J Biol Chem. 2000 Aug 11;275(32):24798-806. | ||||
| REF 3 | Novel folding and stability defects cause a deficiency of human glutathione transferase omega 1. J Biol Chem. 2011 Feb 11;286(6):4271-9. | ||||
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