UniProt Q6PJP8
DCLRE1A (Q6PJP8)
DCLRE1A (UniProt Q6PJP8): 491 experimental structures and 1 predicted model on GenesisL1, 33 ligands bound, 104 pockets. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- Q6PJP8
- Protein
- DCLRE1A
- Experimental structures
- 491
- Predicted models
- 1
- Ligands
- 33
- Pockets
- 104 · 24 records with a druggable one
Structures
492 records of Q6PJP8 in the MolNFT archive: 491 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 4B87 | Crystal structure of human DNA cross-link repair 1A | x-ray diffraction | A | — | — |
| 4B87 | Crystal structure of human DNA cross-link repair 1A | x-ray diffraction | A | — | — |
| 5AHR | Crystal structure of human DNA cross-link repair 1A, crystal form B | x-ray diffraction | A | — | — |
| 5NZW | Crystal structure of DNA cross-link repair protein 1A in complex with ceftriaxone | x-ray diffraction | A | NI, 9F2 | — |
| 5NZW | Crystal structure of DNA cross-link repair protein 1A in complex with ceftriaxone | x-ray diffraction | A | NI, 9F2 | — |
| 5NZX | Crystal structure of DNA cross-link repair protein 1A in complex with Ceftriaxone (alternative site) | x-ray diffraction | A | NI, 9F2 | 3 (best 0.60) |
| 5NZX | Crystal structure of DNA cross-link repair protein 1A in complex with ceftriaxone (alternative site) | x-ray diffraction | A | NI, 9F2 | — |
| 5NZY | Crystal structure of DNA cross-link repair protein 1A in complex with cefotaxime | x-ray diffraction | A | NI, CE3 | — |
| 5Q1J | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMSOA000341B | x-ray diffraction | A | NI, 9KS | — |
| 5Q1K | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000074A | x-ray diffraction | A | NI, AW7 | — |
| 5Q1L | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000073A | x-ray diffraction | A | NI, AWA | — |
| 5Q1M | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000740A | x-ray diffraction | A | NI, AWD | — |
| 5Q1N | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000295A | x-ray diffraction | A | NI, AWG | — |
| 5Q1O | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000478A | x-ray diffraction | A | NI, AWM | — |
| 5Q1P | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A in complex with FMOPL000299a | x-ray diffraction | A | — | — |
| 5Q1P | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000299A | x-ray diffraction | A | NI, AWP | — |
| 5Q1Q | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000294A | x-ray diffraction | A | NI, AWS | — |
| 5Q1R | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000291A | x-ray diffraction | A | NI, AWV | — |
| 5Q1S | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with BDOOA011525C | x-ray diffraction | A | NI, AWY | — |
| 5Q1T | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000492A | x-ray diffraction | A | NI, AXG | — |
| 5Q1U | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000351A | x-ray diffraction | A | NI, AXJ | — |
| 5Q1V | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000166A | x-ray diffraction | A | NI, AXS | — |
| 5Q1W | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000546A | x-ray diffraction | A | NI, AXV | — |
| 5Q1X | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A in complex with FMOPL000085a | x-ray diffraction | A | — | — |
| 5Q1X | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000085A | x-ray diffraction | A | NI, AY4 | — |
| 5Q1Y | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000032A | x-ray diffraction | A | NI, AYJ | — |
| 5Q1Z | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A in complex with FMOPL000150a | x-ray diffraction | A | — | — |
| 5Q1Z | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000150A | x-ray diffraction | A | NI, AYS | — |
| 5Q20 | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000524A | x-ray diffraction | A | NI, AYV | — |
| 5Q22 | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000728A | x-ray diffraction | A | NI, B0A | — |
| 5Q23 | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A in complex with FMOPL000543a | x-ray diffraction | A | — | — |
| 5Q23 | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000543A | x-ray diffraction | A | NI, B0G | — |
| 5Q24 | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000676A | x-ray diffraction | A | NI, B0J | — |
| 5Q25 | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000532A | x-ray diffraction | A | NI, B0M | — |
| 5Q26 | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A in complex with FMOPL000710a | x-ray diffraction | A | — | — |
| 5Q26 | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000710A | x-ray diffraction | A | NI, B0V | — |
| 5Q27 | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000421A | x-ray diffraction | A | B0Y, NI | — |
| 5Q28 | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000186A | x-ray diffraction | A | NI, B1A | — |
| 5Q29 | Pandda analysis group deposition -- crystal structure of DCLRE1A in complex with FMOPL000058A | x-ray diffraction | A | NI, B1J | — |
| 5Q2A | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | — | — |
| 5Q2A | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2B | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | — | — |
| 5Q2B | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2C | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2D | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2E | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | — | — |
| 5Q2E | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2F | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | — | — |
| 5Q2F | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2G | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2H | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2I | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2J | PanDDA analysis group deposition -- Crystal Structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | — | — |
| 5Q2J | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2K | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2L | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2M | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2N | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2O | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
| 5Q2P | Pandda analysis group deposition -- crystal structure of DCLRE1A after initial refinement with no… | x-ray diffraction | A | NI | — |
432 records more on the page itself.
Ligands
- NI · Nickel (II) ion · in 368 records
- 9F2 · Ceftriaxone · in 4 records
- 9KS · N-(2-hydroxyphenyl)acetamide · in 1 record
- AW7 · 2-[4-(1~{H}-pyrazol-3-yl)phenoxy]pyrimidine · in 1 record
- AWA · (6~{R})-6-(4-methoxyphenyl)-2-oxidanylidene-5,6-dihydro-1~{H}-pyrimidine-4-carboxylic acid · in 1 record
- AWD · ~{N}-(4-fluorophenyl)-4-methyl-piperazine-1-carboxamide · in 1 record
- AWG · ~{N}2-(1~{H}-benzimidazol-2-yl)benzene-1,2-diamine · in 1 record
- AWM · 2-(4-methylpiperazin-1-yl)-1,3-benzothiazole · in 1 record
- AWP · 1-cyclohexyl-3-(2-pyridin-4-ylethyl)urea · in 1 record
- AWS · 8-[(dimethylamino)methyl]-4-methyl-7-oxidanyl-chromen-2-one · in 1 record
- AWV · 3-(azepan-1-ylmethyl)-1~{H}-indole · in 1 record
- AWY · ~{N}-[2-(7-methoxynaphthalen-1-yl)ethyl]ethanamide · in 1 record
- AXG · 1-(phenylmethyl)-4-pyrrol-1-yl-piperidine · in 1 record
- AXJ · [(2~{R})-1-[[(1~{R},5~{S})-6,6-dimethyl-2-bicyclo[3.1.1]hept-2-enyl]methyl]pyrrolidin-2-yl]methanol · in 1 record
- AXS · 1-(4-fluorophenyl)-~{N}-[[(2~{R})-oxolan-2-yl]methyl]methanamine · in 1 record
- AXV · 1~{H}-benzimidazol-2-ylcyanamide · in 1 record
- AY4 · 2,4-bis(fluoranyl)-6-(1~{H}-pyrazol-3-yl)phenol · in 1 record
- AYJ · 2-[cyclohexyl(methylsulfonyl)amino]ethanamide · in 1 record
- AYS · 2-[(4-chlorophenyl)amino]benzamide · in 1 record
- AYV · 1-[2-methyl-1,3-bis(oxidanyl)propan-2-yl]-3-phenyl-urea · in 1 record
- B0A · ~{N}-cyclohexyl-2-phenoxy-ethanamide · in 1 record
- B0G · (phenylmethyl) 4-oxidanylpiperidine-1-carboxylate · in 1 record
- B0J · 4-[[[(4~{S})-2,2-dimethyloxan-4-yl]amino]methyl]phenol · in 1 record
- B0M · 1~{H}-indol-6-yl-(4-methylpiperazin-1-yl)methanone · in 1 record
- B0V · 2-methoxy-~{N}-(2,4,6-trimethylphenyl)ethanamide · in 1 record
- B0Y · 5-ethyl-~{N}-[(1-methylpyrazol-4-yl)methyl]thiophene-2-carboxamide · in 1 record
- B1A · ~{N}-(4-phenylazanylphenyl)ethanamide · in 1 record
- B1J · [1-(4-chlorophenyl)-1,2,3-triazol-4-yl]methanol · in 1 record
- CE3 · (6R,7R)-3-(acetyloxymethyl)-7-[[(2Z)-2-(2-amino-1,3-thiazol-4-yl)-2-methoxyimino-ethanoyl]amino]-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid · in 1 record
- R3Z · 1-[(2S)-2,3-dihydro-1,4-benzodioxin-2-ylmethyl]-3-hydroxythieno[3,2-d]pyrimidine-2,4(1H,3H)-dione · in 1 record
Experiment against prediction
- 5Q1O chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.27 Å
- 5Q25 chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.27 Å
- 5Q24 chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.27 Å
- 5Q89 chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.27 Å
- 5Q5R chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.28 Å
- 5Q5R chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.28 Å
- 5Q8O chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.28 Å
- 5Q8O chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.28 Å
- 5Q51 chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.28 Å
- 5Q7E chain A against the predicted model Q6PJP8: TM-score 1.00, RMSD 0.28 Å
Elsewhere
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