Download MendeleyCrystal Structure of Nitroreductase from Enterobacter Cloacae
Hecht, H.J., Bryant, C., Erdmann, H., Pelletier, H., Sawaya, R.To be published.
1NEC
NITROREDUCTASE FROM ENTEROBACTER CLOACAE
- PDB DOI: https://doi.org/10.2210/pdb1NEC/pdb
- Classification: OXIDOREDUCTASE
- Organism(s): Enterobacter cloacae
- Expression System: Escherichia coli
- Mutation(s): No
- Deposited: 1999-03-30 Released: 2000-03-31
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 1.95 Å
- R-Value Free: 0.240
- R-Value Work: 0.180
- R-Value Observed: 0.170
This is version 1.4 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 |
| PROTEIN (NITROREDUCTASE) | 216 | Enterobacter cloacae | Mutation(s): 0 |  | |
UniProt | |||||
Find proteins for Q01234 (Enterobacter cloacae) Explore Q01234 Go to UniProtKB: Q01234 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | Q01234 | ||||
Sequence AnnotationsExpand | |||||
| |||||
Small Molecules
| Ligands 1 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| FMN Query on FMN | E [auth A], F [auth B], G [auth C], H [auth D] | FLAVIN MONONUCLEOTIDE C17 H21 N4 O9 P FVTCRASFADXXNN-SCRDCRAPSA-N |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 1.95 Å
- R-Value Free: 0.240
- R-Value Work: 0.180
- R-Value Observed: 0.170
- Space Group: P 1 21 1
Unit Cell:
| Length ( Å ) | Angle ( ˚ ) |
|---|---|
| a = 44 | α = 90 |
| b = 92.5 | β = 93 |
| c = 102.5 | γ = 90 |
| Software Name | Purpose |
|---|---|
| AMoRE | phasing |
| REFMAC | refinement |
| UCSD-system | data reduction |
| UCSD-system | data scaling |
Entry History
Deposition Data
- Released Date: 2000-03-31 Deposition Author(s): Hecht, H.J., Bryant, C., Erdmann, H., Pelletier, H., Sawaya, R.
Revision History (Full details and data files)
- Version 1.0: 2000-03-31
Type: Initial release - Version 1.1: 2007-10-16
Changes: Version format compliance - Version 1.2: 2011-07-13
Changes: Version format compliance - Version 1.3: 2017-10-04
Changes: Refinement description - Version 1.4: 2023-08-16
Changes: Data collection, Database references, Derived calculations, Refinement description
