3K7Q
Crystal structure of substrate-bound 6-hydroxy-L-nicotine oxidase from Arthrobacter nicotinovorans
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF BEAMLINE ID13 |
| Synchrotron site | ESRF |
| Beamline | ID13 |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2001-11-18 |
| Detector | MAR CCD 130 mm |
| Wavelength(s) | 0.782 |
| Spacegroup name | P 4 3 2 |
| Unit cell lengths | 162.988, 162.988, 162.988 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 12.220 - 2.050 |
| R-factor | 0.20398 |
| Rwork | 0.202 |
| R-free | 0.24967 |
| Structure solution method | MOLREP |
| Starting model (for MR) | 3k7m |
| RMSD bond length | 0.032 |
| RMSD bond angle | 3.007 |
| Data reduction software | DENZO |
| Data scaling software | SCALEPACK |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.2.0019) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.100 |
| High resolution limit [Å] | 2.050 | 2.050 |
| Rmerge | 0.109 | 0.710 |
| Number of reflections | 47039 | |
| <I/σ(I)> | 22 | 3.3 |
| Completeness [%] | 100.0 | 100 |
| Redundancy | 11 | 11 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7.5 | 293 | 20mM Sodium phosphate, 4M sodium formiate, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 293K |
