Download MendeleyLoop Engineering Facilitates the Nicotinamide Cofactors Utilization of BVMOs
Qiang, G., Zheng, Y.C., Feng, L., Yu, H.L.To be published.
8YTT | pdb_00008ytt
Structure of cyclohexanone monooxygenase mutant from Acinetobacter calcoaceticus
- PDB DOI: https://doi.org/10.2210/pdb8YTT/pdb
- Classification: OXIDOREDUCTASE
- Organism(s): Acinetobacter calcoaceticus
- Expression System: Escherichia coli BL21(DE3)
- Mutation(s): Yes
- Deposited: 2024-03-26 Released: 2025-03-26
- Funding Organization(s): National Natural Science Foundation of China (NSFC)
Experimental Data Snapshot
- Method: X-RAY DIFFRACTION
- Resolution: 2.14 Å
- R-Value Free: 0.268 (Depositor), 0.271 (DCC)
- R-Value Work: 0.211 (Depositor), 0.213 (DCC)
- R-Value Observed: 0.214 (Depositor)
Starting Model: experimental
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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 |
| Putative flavin-binding monooxygenase | 548 | Acinetobacter calcoaceticus | Mutation(s): 14 Gene Names: P23_1101 |  | |
UniProt | |||||
Find proteins for A0A0A8XFY0 (Acinetobacter calcoaceticus) Explore A0A0A8XFY0 Go to UniProtKB: A0A0A8XFY0 | |||||
Entity Groups | |||||
| Sequence Clusters | 30% Identity50% Identity70% Identity90% Identity95% Identity100% Identity | ||||
| UniProt Group | A0A0A8XFY0 | ||||
Sequence AnnotationsExpand | |||||
| |||||
Small Molecules
| Ligands 2 Unique | |||||
|---|---|---|---|---|---|
| ID | Chains | Name / Formula / InChI Key | 2D Diagram | 3D Interactions | |
| FAD (Subject of Investigation/LOI) Query on FAD | B [auth A] | FLAVIN-ADENINE DINUCLEOTIDE C27 H33 N9 O15 P2 VWWQXMAJTJZDQX-UYBVJOGSSA-N |  | ||
| NDP (Subject of Investigation/LOI) Query on NDP | C [auth A] | NADPH DIHYDRO-NICOTINAMIDE-ADENINE-DINUCLEOTIDE PHOSPHATE C21 H30 N7 O17 P3 ACFIXJIJDZMPPO-NNYOXOHSSA-N |  | ||
Experimental Data & Validation
Experimental Data
- Method: X-RAY DIFFRACTION
- Resolution: 2.14 Å
- R-Value Free: 0.268 (Depositor), 0.271 (DCC)
- R-Value Work: 0.211 (Depositor), 0.213 (DCC)
- R-Value Observed: 0.214 (Depositor)
Space Group: P 1 21 1
Unit Cell:
| Length ( Å ) | Angle ( ˚ ) |
|---|---|
| a = 52.72 | α = 90 |
| b = 53.22 | β = 96.72 |
| c = 101.61 | γ = 90 |
| Software Name | Purpose |
|---|---|
| PHENIX | refinement |
| XDS | data reduction |
| XDS | data scaling |
| PHASER | phasing |
Entry History & Funding Information
Deposition Data
- Released Date: 2025-03-26 Deposition Author(s): Qiang, G., Zheng, Y.C., Feng, L., Yu, H.L.
| Funding Organization | Location | Grant Number |
|---|---|---|
| National Natural Science Foundation of China (NSFC) | China | 21922804 |
Revision History (Full details and data files)
- Version 1.0: 2025-03-26
Type: Initial release
