Download MendeleyStructure of F93AL57A horse liver alcohol dehydrogenase at 1.60 Angstroms resolution
Zheng, C., Mathews, I.I., Boxer, S.G.To be published.
8ECT
F93AL57A Horse Liver Alcohol Dehydrogenase in Complex with NADH and N-Cyclohexylformamide
- PDB DOI: https://doi.org/10.2210/pdb8ECT/pdb
- Classification: OXIDOREDUCTASE
- Organism(s): Equus caballus
- Expression System: Escherichia coli
- Mutation(s): Yes
- Deposited: 2022-09-02 Released: 2023-09-13
- Funding Organization(s): National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 1.60 Å
- R-Value Free: 0.192
- R-Value Work: 0.178
- R-Value Observed: 0.179
This is version 1.0 of the entry. See complete history.
Literature
To be published.
Macromolecules
Find similar proteins by:
(by identity cutoff) | 3D Structure
Entity ID: 1 | |||||
|---|---|---|---|---|---|
| Molecule | Chains | Sequence Length | Organism | Details | Image |
| Alcohol dehydrogenase E chain | 377 | Equus caballus | Mutation(s): 2 EC: 1.1.1.1 |  | |
UniProt | |||||
Find proteins for P00327 (Equus caballus) Explore P00327 Go to UniProtKB: P00327 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | P00327 | ||||
Sequence AnnotationsExpand | |||||
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Small Molecules
| Ligands 3 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| NAI Query on NAI | E [auth A], I [auth B] | 1,4-DIHYDRONICOTINAMIDE ADENINE DINUCLEOTIDE C21 H29 N7 O14 P2 BOPGDPNILDQYTO-NNYOXOHSSA-N |  | ||
| CXF (Subject of Investigation/LOI) Query on CXF | F [auth A], J [auth B] | CYCLOHEXYLFORMAMIDE C7 H13 N O SWGXDLRCJNEEGZ-UHFFFAOYSA-N |  | ||
| ZN Query on ZN | C [auth A], D [auth A], G [auth B], H [auth B] | ZINC ION Zn PTFCDOFLOPIGGS-UHFFFAOYSA-N |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 1.60 Å
- R-Value Free: 0.192
- R-Value Work: 0.178
- R-Value Observed: 0.179
- Space Group: P 1
Unit Cell:
| Length ( Å ) | Angle ( ˚ ) |
|---|---|
| a = 44.01 | α = 92.67 |
| b = 49.94 | β = 102.92 |
| c = 92.65 | γ = 108.2 |
| Software Name | Purpose |
|---|---|
| XSCALE | data scaling |
| PHENIX | refinement |
| PDB_EXTRACT | data extraction |
| XDS | data reduction |
| PHENIX | phasing |
Entry History & Funding Information
Deposition Data
- Released Date: 2023-09-13 Deposition Author(s): Zheng, C., Mathews, I.I., Boxer, S.G.
| Funding Organization | Location | Grant Number |
|---|---|---|
| National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS) | United States | GM118044 |
| National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS) | United States | P30GM133894 |
Revision History (Full details and data files)
- Version 1.0: 2023-09-13
Type: Initial release
