Target Binding Site Detail
| Target General Information | Top | ||||
|---|---|---|---|---|---|
| Target ID | T99397 | Target Info | |||
| Target Name | Voltage-dependent anion-selective channel 1 (VDAC1) | ||||
| Synonyms | Porin 31HM; Porin 31HL; Plasmalemmal porin; Outer mitochondrial membrane protein porin 1 | ||||
| Target Type | Clinical trial Target | ||||
| Gene Name | VDAC1 | ||||
| Biochemical Class | Eukaryotic mitochondrial porin | ||||
| UniProt ID | |||||
| Ligand General Information | Top | ||||
|---|---|---|---|---|---|
| Ligand Name | Octane | Ligand Info | |||
| Canonical SMILES | CCCCCCCC | ||||
| InChI | 1S/C8H18/c1-3-5-7-8-6-4-2/h3-8H2,1-2H3 | ||||
| InChIKey | TVMXDCGIABBOFY-UHFFFAOYSA-N | ||||
| PubChem Compound ID | 356 | ||||
| Drug Binding Sites of Target | Top | |||||
|---|---|---|---|---|---|---|
| PDB ID: 5XDO Crystal structure of human voltage-dependent anion channel 1 (hVDAC1) in C222 space group | ||||||
| Method | X-ray diffraction | Resolution | 3.10 Å | Mutation | No | [1] |
| PDB Sequence |
MAVPPTYADL
10 GKSARDVFTK20 GYGFGLIKLD30 LKTKSENGLE40 FTSSGSANTE50 TTKVTGSLET 60 KYRWTEYGLT70 FTEKWNTDNT80 LGTEITVEDQ90 LARGLKLTFD100 SSFSPNTGKK 110 NAKIKTGYKR120 EHINLGCDMD130 FDIAGPSIRG140 ALVLGYEGWL150 AGYQMNFETA 160 KSRVTQSNFA170 VGYKTDEFQL180 HTNVNDGTEF190 GGSIYQKVNK200 KLETAVNLAW 210 TAGNSNTRFG220 IAAKYQIDPD230 ACFSAKVNNS240 SLIGLGYTQT250 LKPGIKLTLS 260 ALLDGKNVNA270 GGHKLGLGLE280 FQA
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| PDB ID: 5XDN Crystal structure of human voltage-dependent anion channel 1 (hVDAC1) in P22121 space group | ||||||
| Method | X-ray diffraction | Resolution | 3.15 Å | Mutation | No | [1] |
| PDB Sequence |
GSMAVPPTYA
8 DLGKSARDVF18 TKGYGFGLIK28 LDLKTKGLEF41 TSSGSANTET51 TKVTGSLETK 61 YRWTEYGLTF71 TEKWNTDNTL81 GTEITVEDQL91 ARGLKLTFDS101 SFSPGKKNAK 113 IKTGYKREHI123 NLGCDMDFDI133 AGPSIRGALV143 LGYEGWLAGY153 QMNFETAKSR 163 VTQSNFAVGY173 KTDEFQLHTN183 VNDGTEFGGS193 IYQKVNKKLE203 TAVNLAWTAG 213 NSNTRFGIAA223 KYQIDPDACF233 SAKVNNSSLI243 GLGYTQTLKP253 GIKLTLSALL 263 DGKNAGGHKL275 GLGLEFQA
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| References | Top | ||||
|---|---|---|---|---|---|
| REF 1 | Crystal structural characterization reveals novel oligomeric interactions of human voltage-dependent anion channel 1. Protein Sci. 2017 Sep;26(9):1749-1758. | ||||
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