Download MendeleyCrystal Structure of the N208S Mutant of L-3-Hydroxyacyl-COA Dehydrogenase in Complex with NAD and Acetoacetyl-COA
Barycki, J.J., Banaszak, L.J.To be published.
1M75
Crystal Structure of the N208S Mutant of L-3-Hydroxyacyl-COA Dehydrogenase in Complex with NAD and Acetoacetyl-COA
- PDB DOI: https://doi.org/10.2210/pdb1M75/pdb
- Classification: OXIDOREDUCTASE
- Organism(s): Homo sapiens
- Expression System: Escherichia coli
- Mutation(s): Yes
- Deposited: 2002-07-18 Released: 2004-02-03
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 2.30 ?
- R-Value Free: 0.279
- R-Value Work: 0.228
- R-Value Observed: 0.228
Starting Model: experimental
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This is version 1.5 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 |
| 3-HYDROXYACYL-COA DEHYDROGENASE | 302 | Homo sapiens | Mutation(s): 1 Gene Names: HCDH EC: 1.1.1.35 |  | |
UniProt & NIH Common Fund Data Resources | |||||
Find proteins for Q16836 (Homo sapiens) Explore Q16836 Go to UniProtKB: Q16836 | |||||
PHAROS: Q16836 GTEx: ENSG00000138796 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | Q16836 | ||||
Sequence AnnotationsExpand | |||||
| |||||
Small Molecules
| Ligands 2 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| CAA Query on CAA | C [auth A], E [auth B] | ACETOACETYL-COENZYME A C25 H40 N7 O18 P3 S OJFDKHTZOUZBOS-CITAKDKDSA-N |  | ||
| NAD Query on NAD | D [auth A], F [auth B] | NICOTINAMIDE-ADENINE-DINUCLEOTIDE C21 H27 N7 O14 P2 BAWFJGJZGIEFAR-NNYOXOHSSA-N |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 2.30 ?
- R-Value Free: 0.279
- R-Value Work: 0.228
- R-Value Observed: 0.228
- Space Group: P 21 21 21
Unit Cell:
| Length ( ? ) | Angle ( ? ) |
|---|---|
| a = 50.151 | ¦Á = 90 |
| b = 87.597 | ¦Â = 90 |
| c = 158.545 | ¦Ă = 90 |
| Software Name | Purpose |
|---|---|
| CRYSTAL | data collection |
| CRYSTAL | data reduction |
| CNS | refinement |
| CrystalClear | data reduction |
| CrystalClear | data scaling |
| CNS | phasing |
Entry History
Deposition Data
- Released Date: 2004-02-03 Deposition Author(s): Barycki, J.J., Banaszak, L.J.
Revision History (Full details and data files)
- Version 1.0: 2004-02-03
Type: Initial release - Version 1.1: 2008-04-28
Changes: Version format compliance - Version 1.2: 2011-07-13
Changes: Version format compliance - Version 1.3: 2018-04-04
Changes: Data collection - Version 1.4: 2021-10-27
Changes: Database references, Derived calculations - Version 1.5: 2024-02-14
Changes: Data collection, Refinement description
