7SNM
Lanosterol-bound P450 domain of the CYP51-ferredoxin fusion protein from Methylococcus capsulatus
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | APS BEAMLINE 21-ID-G |
Synchrotron site | APS |
Beamline | 21-ID-G |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2021-06-10 |
Detector | CS-PAD CXI-1 |
Wavelength(s) | 1.000 |
Spacegroup name | P 1 21 1 |
Unit cell lengths | 73.210, 206.160, 81.430 |
Unit cell angles | 90.00, 114.09, 90.00 |
Refinement procedure
Resolution | 74.450 - 2.550 |
R-factor | 0.2073 |
Rwork | 0.204 |
R-free | 0.24580 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 6mi0 |
RMSD bond length | 0.002 |
RMSD bond angle | 1.265 |
Data reduction software | HKL-2000 |
Data scaling software | Aimless |
Phasing software | PHASER |
Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 74.450 | 2.620 |
High resolution limit [Å] | 2.550 | 2.550 |
Rmerge | 0.065 | 0.637 |
Number of reflections | 67008 | 4997 |
<I/σ(I)> | 13.4 | 2.2 |
Completeness [%] | 99.0 | 99.9 |
Redundancy | 7.1 | 7.4 |
CC(1/2) | 0.998 | 0.960 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION | 7.1 | 298 | Na-citrate tribasic dehydrate, PEG 8,000, dodecyltrimethylammonium chloride |