UniProt O67648
O67648
O67648 (UniProt O67648): 38 experimental structures and 1 predicted model on GenesisL1, 8 ligands bound. Binding sites, druggability and experiment against prediction (TM-score) in GL1X.
- UniProt
- O67648
- Experimental structures
- 38
- Predicted models
- 1
- Ligands
- 8
Structures
39 records of O67648 in the MolNFT archive: 38 experimental, 1 predicted.
| Entry | Title | Method | Chains | Ligands | Pockets |
|---|---|---|---|---|---|
| 1P42 | Crystal structure of Aquifex aeolicus LpxC Deacetylase (Zinc-Inhibited Form) | x-ray diffraction | A, B | — | — |
| 1P42 | Crystal structure of aquifex aeolicus lpxc deacetylase (zinc-inhibited form) | x-ray diffraction | A, B | — | — |
| 1XXE | RDC refined solution structure of the AaLpxC/TU-514 complex | solution nmr | A | — | — |
| 1XXE | Rdc refined solution structure of the AALPXC/TU-514 complex | solution nmr | A | — | — |
| 1YH8 | Crystal structure of Aquifex aeolicus LpxC deacetylase complexed with palmitate | x-ray diffraction | A, B | — | — |
| 1YH8 | Crystal structure of aquifex aeolicus lpxc deacetylase complexed with palmitate | x-ray diffraction | A, B | — | — |
| 1YHC | Crystal structure of Aquifex aeolicus LpxC deacetylase complexed with cacodylate | x-ray diffraction | A, B | — | — |
| 1YHC | Crystal structure of aquifex aeolicus lpxc deacetylase complexed with cacodylate | x-ray diffraction | A, B | — | — |
| 2GO3 | Crystal structure of Aquifex aeolicus LpxC complexed with imidazole. | x-ray diffraction | A, B | — | — |
| 2GO3 | Crystal structure of aquifex aeolicus lpxc complexed with imidazole. | x-ray diffraction | A, B | — | — |
| 2GO4 | Crystal structure of Aquifex aeolicus LpxC complexed with TU-514 | x-ray diffraction | A, B | — | — |
| 2GO4 | Crystal structure of aquifex aeolicus lpxc complexed with tu-514 | x-ray diffraction | A, B | — | — |
| 2IER | Crystal Structure of Aquifex aeolicus LpxC Complexed with Uridine 5'-Diphosphate | x-ray diffraction | A, B | — | — |
| 2IER | Crystal structure of aquifex aeolicus lpxc complexed with uridine 5'- diphosphate | x-ray diffraction | A, B | — | — |
| 2IES | Crystal Structure of Aquifex aeolicus LpxC Complexed with Pyrophosphate | x-ray diffraction | A, B | — | — |
| 2IES | Crystal structure of aquifex aeolicus lpxc complexed with pyrophosphate | x-ray diffraction | A, B | — | — |
| 2J65 | Structure of LpxC from Aquifex aeolicus in complex with UDP | x-ray diffraction | A, B | — | — |
| 2J65 | Structure of lpxc from aquifex aeolicus in complex with udp | x-ray diffraction | A, B | — | — |
| 2JT2 | Solution Structure of the Aquifex aeolicus LpxC- CHIR-090 complex | solution nmr | A | — | — |
| 2JT2 | Solution structure of the aquifex aeolicus lpxc- chir-090 complex | solution nmr | A | — | — |
| 2O3Z | X-ray crystal structure of LpxC complexed with 3-heptyloxybenzoate | x-ray diffraction | A, B | — | — |
| 2O3Z | X-ray crystal structure of lpxc complexed with 3-heptyloxybenzoate | x-ray diffraction | A, B | — | — |
| 3P3C | Crystal Structure of the Aquifex aeolicus LpxC/LPC-009 complex | x-ray diffraction | A | — | — |
| 3P3C | Crystal structure of the aquifex aeolicus LPXC/LPC-009 complex | x-ray diffraction | A | — | — |
| 3P76 | X-ray crystal structure of Aquifex aeolicus LpxC complexed SCH1379777 | x-ray diffraction | A | — | — |
| 3P76 | X-ray crystal structure of aquifex aeolicus lpxc complexed SCH1379777 | x-ray diffraction | A | — | — |
| 4OZE | A.aolicus LpxC in complex with native product | x-ray diffraction | A, B | — | — |
| 4OZE | A.AOLICUS lpxc in complex with native product | x-ray diffraction | A, B | — | — |
| 4U3B | LpxC from A.Aaeolicus in complex with the MMP inhibitor… | x-ray diffraction | A | — | — |
| 4U3B | Lpxc from A.AAEOLICUS in complex with the mmp inhibitor 4-[[4-(4… | x-ray diffraction | A | — | — |
| 4U3D | LpxC from A.Aaeolicus in complex with 4-[[4-[2-[4-(morpholinomethyl)phenyl]ethynyl]phenoxy]methyl]te… | x-ray diffraction | A | — | — |
| 4U3D | Lpxc from A.AAEOLICUS in complex with 4-[[4-[2-[4-(morpholinomethyl)… | x-ray diffraction | A | — | — |
| 5DRO | Structure of the Aquifex aeolicus LpxC/LPC-011 Complex | x-ray diffraction | A, B | ZN, ZH2 | — |
| 5DRO | Structure of the aquifex aeolicus LPXC/LPC-011 complex | x-ray diffraction | A, B | — | — |
| 5DRP | Structure of the AaLpxC/LPC-023 Complex | x-ray diffraction | A, B | ZN, 5EP, CL | — |
| 5DRP | Structure of the AALPXC/LPC-023 complex | x-ray diffraction | A, B | — | — |
| 5U86 | Structure of the aquifex aeolicus LPXC/LPC-069 complex | x-ray diffraction | A | ZN, 81V, CL, PO4 | — |
| 6IH0 | Aquifex aeolicus lpxc complex with achn-975 | x-ray diffraction | A | A5F, ZN, A5U | — |
| O67648 | AlphaFold monomer V2.0 prediction for udp-3-O-acyl-N- acetylglucosamine deacetylase (O67648) | predicted | A | — | — |
Ligands
- ZN · Zinc ion · in 4 records
- CL · Chloride ion · in 2 records
- 5EP · N~2~-{4-[4-(4-aminophenyl)buta-1,3-diyn-1-yl]benzoyl}-N-hydroxy-L-isoleucinamide · in 1 record
- 81V · N-[(2S,3S)-4,4-difluoro-3-hydroxy-1-(hydroxyamino)-3-methyl-1-oxobutan-2-yl]-4-({4-[(morpholin-4-yl) methyl]phenyl}ethynyl)benzamide · in 1 record
- A5F · N-[(2S)-3-azanyl-3-methyl-1-(oxidanylamino)-1-oxidanylidene-butan-2-yl]-4-[4-[(1R,2R)-2-(hydroxymethyl)cyclopropyl]buta -1,3-diynyl]benzamide · in 1 record
- A5U · Methyl (2S)-2-azanyl-3-methyl-3-[(2-methylpropan-2-yl) oxycarbonylamino]butanoate · in 1 record
- PO4 · Phosphate ion · in 1 record
- ZH2 · 4-[4-(4-aminophenyl)buta-1,3-diyn-1-yl]-N-[(2S,3R)-3-hydroxy-1-(hydroxyamino)-1-oxobutan-2-yl]benzamide · in 1 record
Experiment against prediction
- 5U86 chain A against the predicted model O67648: TM-score 1.00, RMSD 0.17 Å
- 6IH0 chain A against the predicted model O67648: TM-score 1.00, RMSD 0.18 Å
- 3P76 chain A against the predicted model O67648: TM-score 1.00, RMSD 0.25 Å
- 3P76 chain A against the predicted model O67648: TM-score 1.00, RMSD 0.25 Å
- 4U3D chain A against the predicted model O67648: TM-score 1.00, RMSD 0.25 Å
- 4U3D chain A against the predicted model O67648: TM-score 1.00, RMSD 0.25 Å
- 4U3B chain A against the predicted model O67648: TM-score 1.00, RMSD 0.26 Å
- 4U3B chain A against the predicted model O67648: TM-score 1.00, RMSD 0.26 Å
- 1YHC chain A against the predicted model O67648: TM-score 1.00, RMSD 0.35 Å
- 1YHC chain A against the predicted model O67648: TM-score 1.00, RMSD 0.35 Å
Elsewhere
GL1X is a live explorer of the GenesisL1 blockchain. Turn on JavaScript for search, charts and interactive views.