UniProt Q16548
Bcl-2-related protein A1 (Q16548)
Bcl-2-related protein A1 (UniProt Q16548): 25 experimental structures and 1 predicted model on GenesisL1, 8 ligands bound, 3 pockets. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- Q16548
- Protein
- Bcl-2-related protein A1
- Experimental structures
- 25
- Predicted models
- 1
- Ligands
- 8
- Pockets
- 3 · 0 records with a druggable one
Structures
26 records of Q16548 in the MolNFT archive: 25 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 2VM6 | Human Bcl2-A1 in complex with Bim-BH3 peptide | x-ray diffraction | A | — | — |
| 2VM6 | Human BCL2-A1 in complex with bim-BH3 peptide | x-ray diffraction | A | — | — |
| 3I1H | Crystal structure of human BFL-1 in complex with BAK BH3 peptide | x-ray diffraction | A | — | — |
| 3I1H | Crystal structure of human bfl-1 in complex with bak BH3 peptide | x-ray diffraction | A | — | — |
| 3MQP | Crystal Structure of human BFL-1 in complex with NOXA BH3 peptide, Northeast Structural Genomics… | x-ray diffraction | A | — | — |
| 3MQP | Crystal structure of human bfl-1 in complex with noxa BH3 peptide, northeast structural genomics… | x-ray diffraction | A | — | — |
| 4ZEQ | Crystal structure of human bfl-1 in complex with tbid BH3 peptide, northeast structural genomics… | x-ray diffraction | A | — | — |
| 5UUK | Human Bfl-1 in complex with a Bfl-1-specific selected peptide | x-ray diffraction | A | SO4 | — |
| 5UUK | Human bfl-1 in complex with a bfl-1-specific selected peptide | x-ray diffraction | A | SO4 | — |
| 5UUL | Human Bfl-1 in complex with PUMA BH3 | x-ray diffraction | A | — | — |
| 5UUL | Human bfl-1 in complex with puma BH3 | x-ray diffraction | A | — | — |
| 5UUP | Human bfl-1 covalently cross-linked to an electrophilic variant of a bfl-1-specific selected peptide | x-ray diffraction | A | AKR, SO4 | — |
| 5WHH | Crystal Structure of Bcl-2-related protein A1 in complex with stapled peptide… | x-ray diffraction | A | CL | — |
| 5WHH | Crystal structure of BCL-2-related protein A1 in complex with stapled peptide… | x-ray diffraction | A | 0EH, CL | — |
| 5WHI | Crystal structure of BCL-2-related protein A1 | x-ray diffraction | A | CAD | — |
| 6E3I | Human Bfl-1 in complex with the Bfl-1-specific designed peptide srt.F4 | x-ray diffraction | A | SO4 | — |
| 6E3I | Human bfl-1 in complex with the bfl-1-specific designed peptide SRT.F4 | x-ray diffraction | A | NH2, SO4 | — |
| 6E3J | Human bfl-1 in complex with the bfl-1-specific designed peptide SRT.F10 | x-ray diffraction | A | NH2, SO4 | — |
| 6MBB | Human bfl-1 in complex with the designed peptide DF1 | x-ray diffraction | A | — | — |
| 6MBC | Human bfl-1 in complex with the designed peptide DF4 | x-ray diffraction | A | — | — |
| 6RJP | Bfl-1 in complex with alpha helical peptide | x-ray diffraction | A, B | — | — |
| 6VO4 | Crystal Structure Analysis of BFL1 | x-ray diffraction | A | — | — |
| 6VO4 | Crystal structure analysis of BFL1 | x-ray diffraction | A | — | — |
| 9FKZ | Discovery of a Series of Covalent, Cell Active Bfl-1 Inhibitors | x-ray diffraction | A | A1IDO | 2 (best 0.44) |
| 9GIT | BFL1 covalently bound to inhibitor compound 43 | x-ray diffraction | A | A1ILW | 1 (best 0.42) |
| Q16548 | AlphaFold monomer V2.0 prediction for BCL-2-related protein A1 (Q16548) | predicted | A | — | — |
Ligands
- SO4 · Sulfate ion · in 6 records
- CL · Chloride ion · in 2 records
- NH2 · Amino group · in 2 records
- 0EH · (2R)-2-amino-2-methylnonanoic acid · in 1 record
- A1IDO · ~{N}-[4-[(1~{R},3~{R})-3-azanylcyclopentyl]oxyphenyl]-~{N}-[(4-chlorophenyl)methyl]prop-2-enamide · in 1 record
- A1ILW · (3~{S})-3-[[4-[(1~{R},3~{R})-3-[[(3~{R})-1,1-bis(oxidanylidene)thiolan-3-yl]carbamoylamino]cyclopentyl]oxy-3-fluoranyl-phenyl]-propanoyl-amino]-3-(4-chlorophenyl)propanamide · in 1 record
- AKR · Acrylic acid · in 1 record
- CAD · Cacodylic acid · in 1 record
Experiment against prediction
- 4ZEQ chain A against the predicted model Q16548: TM-score 0.98, RMSD 0.79 Å
- 3MQP chain A against the predicted model Q16548: TM-score 0.98, RMSD 0.83 Å
- 3MQP chain A against the predicted model Q16548: TM-score 0.98, RMSD 0.83 Å
- 9GIT chain A against the predicted model Q16548: TM-score 0.97, RMSD 0.85 Å
- 6MBC chain A against the predicted model Q16548: TM-score 0.97, RMSD 0.76 Å
- 3I1H chain A against the predicted model Q16548: TM-score 0.97, RMSD 0.88 Å
- 3I1H chain A against the predicted model Q16548: TM-score 0.97, RMSD 0.88 Å
- 6E3J chain A against the predicted model Q16548: TM-score 0.97, RMSD 0.78 Å
- 5UUP chain A against the predicted model Q16548: TM-score 0.97, RMSD 0.81 Å
- 6E3I chain A against the predicted model Q16548: TM-score 0.97, RMSD 0.79 Å
Elsewhere
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