UniProt A0A3L6KZJ1
N(1),N(8)-bis(glutathionyl)spermidine reductase (A0A3L6KZJ1)
N(1),N(8)-bis(glutathionyl)spermidine reductase (UniProt A0A3L6KZJ1), EC 1.8.1.12: 27 experimental structures on GenesisL1, 18 ligands bound, 104 pockets. Binding sites, pockets, druggability and 3D structures in GL1X.
- UniProt
- A0A3L6KZJ1
- Protein
- N(1),N(8)-bis(glutathionyl)spermidine reductase
- EC
- 1.8.1.12
- Experimental structures
- 27
- Predicted models
- 0
- Ligands
- 18
- Pockets
- 104 · 11 records with a druggable one
Structures
27 records of A0A3L6KZJ1 in the MolNFT archive: 27 experimental, 0 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 5S9S | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, AXG, MG, BR | 9 (best 0.86) |
| 5S9S | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, AXG, MG, BR | — |
| 5S9T | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, GQJ, MG, BR | — |
| 5S9T | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, GQJ, MG, BR | — |
| 5S9U | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, JMM, MG, BR | — |
| 5S9V | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, NUY, MG, BR | 8 (best 0.86) |
| 5S9V | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, NUY, MG, BR | — |
| 5S9W | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, N08, MG, BR | 6 (best 0.87) |
| 5S9W | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, N08, MG, BR | — |
| 5S9X | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, K1A, MG, BR | 10 (best 0.86) |
| 5S9X | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, K1A, MG, BR | — |
| 5S9Y | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, 6SU, MG, BR | 10 (best 0.86) |
| 5S9Y | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, 6SU, MG, BR | — |
| 5S9Z | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, O3J, MG, BR | 8 (best 0.87) |
| 5S9Z | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, O3J, MG, BR | — |
| 5SA0 | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, NXJ, MG, BR | 9 (best 0.86) |
| 5SA0 | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, NXJ, MG, BR | — |
| 5SA1 | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, AWD, MG, BR | — |
| 5SA1 | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, AWD, MG, BR | — |
| 5SA2 | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, MG, WKY, BR | — |
| 5SA2 | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, MG, WKY, BR | — |
| 5SA3 | PanDDA analysis group deposition -- Crystal Structure of Trypanosoma brucei Trypanothione reductase… | x-ray diffraction | A, B | FAD, MG, O0M, BR | 7 (best 0.87) |
| 5SA3 | Pandda analysis group deposition -- crystal structure of trypanosoma brucei trypanothione reductase… | x-ray diffraction | A, B | FAD, MG, O0M, BR | — |
| 5SMJ | Trypanothione reductase | x-ray diffraction | A, B | FAD, MG, BR | — |
| 8PF3 | Crystal structure of Trypanosoma brucei trypanothione reductase in complex with… | x-ray diffraction | A, B, C, D | FAD, YJ6 | 14 (best 0.86) |
| 8PF4 | Crystal structure of Trypanosoma brucei trypanothione reductase in complex with… | x-ray diffraction | A, B, C, D | FAD, YIA | 12 (best 0.87) |
| 8PF5 | Crystal structure of Trypanosoma brucei trypanothione reductase in complex with… | x-ray diffraction | A, B, C, D | FAD, YJK | 11 (best 0.86) |
Ligands
- FAD · Flavin-adenine dinucleotide · in 27 records
- BR · Bromide ion · in 24 records
- MG · Magnesium ion · in 24 records
- 6SU · methyl 3-(methylsulfonylamino)benzoate · in 2 records
- AWD · ~{N}-(4-fluorophenyl)-4-methyl-piperazine-1-carboxamide · in 2 records
- AXG · 1-(phenylmethyl)-4-pyrrol-1-yl-piperidine · in 2 records
- GQJ · methyl (2~{S},4~{R})-1-(furan-2-ylcarbonyl)-4-oxidanyl-pyrrolidine-2-carboxylate · in 2 records
- K1A · 3-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-5-methyl-1,3,4-thiadiazol-2(3H)-one · in 2 records
- N08 · ~{N}-[2-(4-fluorophenyl)ethyl]furan-2-carboxamide · in 2 records
- NUY · [4-(propan-2-yl)piperazin-1-yl](thiophen-2-yl)methanone · in 2 records
- NXJ · (1S)-N,2,2-trimethyl-N-(pyridin-3-yl)cyclopropane-1-carboxamide · in 2 records
- O0M · 1-{[4-(propan-2-yl)phenyl]methyl}piperidin-4-ol · in 2 records
- O3J · 1-[4-(3-phenylpropyl)piperazin-1-yl]ethan-1-one · in 2 records
- WKY · N-(3-methylpyridin-4-yl)acetamide · in 2 records
- JMM · [4-(cyclopropanecarbonyl)piperazin-1-yl](furan-2-yl) methanone · in 1 record
- YIA · ~{N}-(4-fluorophenyl)-~{N}-[[5-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-yl]methyl]-4-methyl-4-(3-phenylpropyl)-1,4$l^{4}-diazinane-1-carboxamide · in 1 record
- YJ6 · 4-[(3,4-dichlorophenyl)methyl]-~{N}-(4-fluorophenyl)-~{N}-[[5-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-yl]methyl]-4-(3-phenylpropyl)-1,4$l^{4}-diazinane-1-carboxamide · in 1 record
- YJK · 4-[(3,4-dichlorophenyl)methyl]-~{N}-[[5-[2-(4-fluorophenyl)ethylcarbamoyl]furan-2-yl]methyl]-4-(3-phenylpropyl)-1,4$l^{4}-diazinane-1-carboxamide · in 1 record
Elsewhere
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