Download MendeleyEfficient Synthesis of (R)-2-Chloro-1-(2,4-dichlorophenyl)ethanol with a Ketoreductase from Scheffersomyces stipitis CBS 6045
Shang, Y.P., Chen, Q., Kong, X.D., Zhang, Y.J., Xu, J.H., Yu, H.L.(2017) Adv Synth Catal 359: 426-431
5GMO
X-ray structure of carbonyl reductase SsCR
- PDB DOI: https://doi.org/10.2210/pdb5GMO/pdb
- Classification: OXIDOREDUCTASE
- Organism(s): Scheffersomyces stipitis CBS 6054
- Expression System: Escherichia coli 'BL21-Gold(DE3)pLysS AG
- Mutation(s): No
- Deposited: 2016-07-14 Released: 2017-01-25
- Funding Organization(s): the National Natural Science Foundation of China, Shanghai Science and Technology Program, SKLBE
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 2.30 Å
- R-Value Free: 0.238
- R-Value Work: 0.182
- R-Value Observed: 0.185
wwPDB Validation 3D Report Full Report
This is version 1.2 of the entry. See complete history.
Literature
Macromolecules
Find similar proteins by:
(by identity cutoff) | 3D Structure
Entity ID: 1 | |||||
|---|---|---|---|---|---|
| Molecule | Chains | Sequence Length | Organism | Details | Image |
| Protein induced by osmotic stress | 334 | Scheffersomyces stipitis CBS 6054 | Mutation(s): 0 Gene Names: GRP3.1, PICST_32463 EC: 1.1.1.195 |  | |
UniProt | |||||
Find proteins for A3LWG4 (Scheffersomyces stipitis (strain ATCC 58785 / CBS 6054 / NBRC 10063 / NRRL Y-11545)) Explore A3LWG4 Go to UniProtKB: A3LWG4 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | A3LWG4 | ||||
Sequence AnnotationsExpand | |||||
| |||||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 2.30 Å
- R-Value Free: 0.238
- R-Value Work: 0.182
- R-Value Observed: 0.185
- Space Group: P 21 21 21
Unit Cell:
| Length ( Å ) | Angle ( ˚ ) |
|---|---|
| a = 47.648 | α = 90 |
| b = 52.862 | β = 90 |
| c = 140.141 | γ = 90 |
| Software Name | Purpose |
|---|---|
| PHENIX | refinement |
| HKL-2000 | data reduction |
| HKL-2000 | data scaling |
Entry History & Funding Information
Deposition Data
- Released Date: 2017-01-25 Deposition Author(s): Shang, Y.P., Yu, H.L., Xu, J.H.
| Funding Organization | Location | Grant Number |
|---|---|---|
| the National Natural Science Foundation of China | China | 21276082 |
| Shanghai Science and Technology Program | China | 15JC1400403 |
| SKLBE | China | 2060204 |
Revision History (Full details and data files)
- Version 1.0: 2017-01-25
Type: Initial release - Version 1.1: 2017-02-22
Changes: Database references - Version 1.2: 2023-11-08
Changes: Data collection, Database references, Refinement description
