4AW3
Structure of the mixed-function P450 MycG F286V mutant in complex with mycinamicin V in P1 space group
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 8.3.1 |
| Synchrotron site | ALS |
| Beamline | 8.3.1 |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2012-02-27 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 |
| Unit cell lengths | 55.455, 56.107, 76.422 |
| Unit cell angles | 90.43, 97.22, 102.11 |
Refinement procedure
| Resolution | 75.770 - 2.050 |
| R-factor | 0.16934 |
| Rwork | 0.166 |
| R-free | 0.23470 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2y98 |
| RMSD bond length | 0.022 |
| RMSD bond angle | 2.028 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 75.770 | 2.160 |
| High resolution limit [Å] | 2.050 | 2.050 |
| Rmerge | 0.170 | 0.540 |
| Number of reflections | 54108 | |
| <I/σ(I)> | 4.1 | 1.7 |
| Completeness [%] | 96.6 | 95.7 |
| Redundancy | 2.1 | 2.2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 6.5 | 1.6 M AMMONIUM SULFATE, 0.1 M MES PH6.5, 10% V/V 1,4-DIOXANE |
