UniProt P25098
Beta-adrenergic receptor kinase 1 (P25098)
Beta-adrenergic receptor kinase 1 (UniProt P25098), EC 2.7.11.15: 34 experimental structures and 1 predicted model on GenesisL1, 16 ligands bound, 23 pockets. Binding sites, druggability and experiment against prediction…
- UniProt
- P25098
- Protein
- Beta-adrenergic receptor kinase 1
- EC
- 2.7.11.15
- Experimental structures
- 34
- Predicted models
- 1
- Ligands
- 16
- Pockets
- 23 · 3 records with a druggable one
Structures
35 records of P25098 in the MolNFT archive: 34 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1BAK | Signal transduction pleckstrin homology domain of G-protein coupled receptor kinase 2… | solution nmr | A | — | — |
| 1BAK | Signal transduction pleckstrin homology domain of G-protein coupled receptor kinase 2… | solution nmr | A | — | — |
| 3CIK | Human GRK2 in Complex with Gbetagamma subunits | x-ray diffraction | A | — | — |
| 3CIK | Human GRK2 in complex with gbetagamma subunits | x-ray diffraction | A | — | — |
| 3KRW | Human GRK2 in complex with Gbetgamma subunits and balanol (soak) | x-ray diffraction | A | — | — |
| 3KRW | Human GRK2 in complex with gbetgamma subunits and balanol (soak) | x-ray diffraction | A | — | — |
| 3KRX | Human GRK2 in complex with Gbetgamma subunits and balanol (co-crystal) | x-ray diffraction | A | — | — |
| 3KRX | Human GRK2 in complex with gbetgamma subunits and balanol (co-crystal) | x-ray diffraction | A | — | — |
| 3V5W | Human G Protein-Coupled Receptor Kinase 2 in Complex with Soluble Gbetagamma Subunits and Paroxetine | x-ray diffraction | A | — | — |
| 3V5W | Human G protein-coupled receptor kinase 2 in complex with soluble gbetagamma subunits and paroxetine | x-ray diffraction | A | — | — |
| 4MK0 | Crystal structure of G protein-coupled receptor kinase 2 in complex with a a rationally designed… | x-ray diffraction | A | — | — |
| 4MK0 | Crystal structure of G protein-coupled receptor kinase 2 in complex with a a rationally designed… | x-ray diffraction | A | — | — |
| 4PNK | G protein-coupled receptor kinase 2 in complex with GSK180736A | x-ray diffraction | A | — | — |
| 4PNK | G protein-coupled receptor kinase 2 in complex with GSK180736A | x-ray diffraction | A | — | — |
| 5HE1 | Human GRK2 in complex with Gbetagamma subunits and CCG224062 | x-ray diffraction | A | ZS2, MG | — |
| 5HE1 | Human GRK2 in complex with gbetagamma subunits and CCG224062 | x-ray diffraction | A | — | — |
| 5UKK | Human GRK2 in complex with human G-beta-gamma subunits and CCG211998 (14ak) | x-ray diffraction | A | MG, 8DJ | — |
| 5UKK | Human GRK2 in complex with human G-beta-gamma subunits and CCG211998 (14AK) | x-ray diffraction | A | MG, 8DJ | — |
| 5UKL | Human GRK2 in complex with Gbetagamma subunits and CCG222886 (14bd) | x-ray diffraction | A | MG, SIX | 7 (best 0.79) |
| 5UKL | Human GRK2 in complex with gbetagamma subunits and CCG222886 (14BD) | x-ray diffraction | A | MG, SIX | — |
| 5UUU | Design, synthesis, and evaluation of the first selective and potent G- protein-coupled receptor… | x-ray diffraction | A | QRW, SO4 | — |
| 5UVC | Design, Synthesis, and Evaluation of the First Selective and Potent G-protein-Coupled Receptor… | x-ray diffraction | A | 8PV, SO4 | 7 (best 0.64) |
| 5UVC | Design, synthesis, and evaluation of the first selective and potent G- protein-coupled receptor… | x-ray diffraction | A | 8PV, SO4 | — |
| 5WG3 | Human GRK2 in complex with Gbetagamma subunits and CCG258748 | x-ray diffraction | A | AFM, MG | 9 (best 0.79) |
| 5WG3 | Human GRK2 in complex with gbetagamma subunits and CCG258748 | x-ray diffraction | A | AFM, MG | — |
| 5WG4 | Human GRK2 in complex with Gbetagamma subunits and CCG257284 | x-ray diffraction | A | AFV | — |
| 5WG4 | Human GRK2 in complex with gbetagamma subunits and CCG257284 | x-ray diffraction | A | AFV | — |
| 5WG5 | Human GRK2 in complex with gbetagamma subunits and CCG224061 | x-ray diffraction | A | ZSO, MG | — |
| 6C2Y | Human GRK2 in complex with Gbetagamma subunits and CCG257142 | x-ray diffraction | A | EJS | — |
| 6C2Y | Human GRK2 in complex with gbetagamma subunits and CCG257142 | x-ray diffraction | A | EJS | — |
| 6U7C | Human GRK2 in complex with gbetagamma subunits and CCG258747 | x-ray diffraction | A | Q1Y, MG | — |
| 7K7L | Structure of a hit for G protein coupled receptor kinase 2 (GRK2) inhibitor for the potential… | x-ray diffraction | A | MG, W4D | — |
| 7K7Z | Structure of a hit for G protein coupled receptor kinase 2 (GRK2) inhibitor for the potential… | x-ray diffraction | A | W4G | — |
| 7PWD | Structure of an inhibited GRK2-G-beta and G-gamma complex | x-ray diffraction | A | 8DS, CL | — |
| P25098 | AlphaFold monomer V2.0 prediction for beta-adrenergic receptor kinase 1 (P25098) | predicted | A | — | — |
Ligands
- MG · Magnesium ion · in 10 records
- SO4 · Sulfate ion · in 3 records
- 8DJ · 5-[(3S,4R)-3-{[(2H-1,3-benzodioxol-5-yl)oxy]methyl}piperidin-4-yl]-2-fluoro-N-[(pyridin-2-yl)methyl]benzamide · in 2 records
- 8PV · N-benzyl-3-({[5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}amino)benzamide · in 2 records
- AFM · 2-fluoro-5-[(3S,4R)-3-{[(1H-indazol-5-yl) oxy]methyl}piperidin-4-yl]-N-[(1H-pyrazol-3-yl) methyl]benzamide · in 2 records
- AFV · 2-fluoro-5-[(3S,4R)-3-{[(1H-indazol-5-yl) oxy]methyl}piperidin-4-yl]-N-[(pyridin-2-yl) methyl]benzamide · in 2 records
- EJS · (4R,5R,6S)-4-[4-fluoro-3-({[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl}carbamoyl)phenyl]-N-(2H-indazol-5-yl)-6-methyl-2-oxohexahydropyrimidine-5-carboxamide · in 2 records
- SIX · 2-{5-[(3S,4R)-3-{[(2H-1,3-benzodioxol-5-yl) oxy]methyl}piperidin-4-yl]-2-fluorophenyl}-N-[2-(1H-pyrazol-4-yl)ethyl]acetamide · in 2 records
- 8DS · 4-chloranyl-N-[2-(4-chlorophenyl)ethyl]thieno[2,3-c]pyridine-2-carboxamide · in 1 record
- CL · Chloride ion · in 1 record
- Q1Y · 5-[(3S,4R)-3-{[(2H-1,3-benzodioxol-5-yl) oxy]methyl}piperidin-4-yl]-2-fluoro-N-[(2H-indazol-3-yl)methyl]benzamide · in 1 record
- QRW · 3-({[4-methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}amino)-N-[2-(trifluoromethyl) benzyl]benzamide · in 1 record
- W4D · 3-benzyl-6-(1H-pyrazol-4-yl)quinazolin-4(3H)-one · in 1 record
- W4G · 3-benzyl-7-(1H-pyrazol-4-yl)quinazolin-4(3H)-one · in 1 record
- ZS2 · (4~{S})-4-[4-fluoranyl-3-(isoquinolin-1-ylmethylcarbamoyl)phenyl]-~{N}-(1~{H}-indazol-5-yl)-6-methyl-2-oxidanylidene-3,4-dihydro-1~{H}-pyrimidine-5-carboxamide · in 1 record
- ZSO · 5-{[(3S,4R)-4-(4-fluorophenyl)piperidin-3-yl]methoxy}-2H-indazole · in 1 record
Experiment against prediction
- 3KRX chain A against the predicted model P25098: TM-score 0.99, RMSD 0.85 Å
- 3KRX chain A against the predicted model P25098: TM-score 0.99, RMSD 0.85 Å
- 6C2Y chain A against the predicted model P25098: TM-score 0.99, RMSD 0.84 Å
- 6C2Y chain A against the predicted model P25098: TM-score 0.99, RMSD 0.84 Å
- 3KRW chain A against the predicted model P25098: TM-score 0.99, RMSD 0.86 Å
- 3KRW chain A against the predicted model P25098: TM-score 0.99, RMSD 0.86 Å
- 3CIK chain A against the predicted model P25098: TM-score 0.99, RMSD 0.96 Å
- 3CIK chain A against the predicted model P25098: TM-score 0.99, RMSD 0.96 Å
- 7K7L chain A against the predicted model P25098: TM-score 0.99, RMSD 1.03 Å
- 5UUU chain A against the predicted model P25098: TM-score 0.99, RMSD 0.85 Å
Elsewhere
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