2Y46
Structure of the mixed-function P450 MycG in complex with mycinamicin IV in C 2 2 21 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 | 2010-01-04 |
| Detector | MARRESEARCH |
| Spacegroup name | C 2 2 21 |
| Unit cell lengths | 58.271, 101.013, 441.534 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 220.770 - 1.830 |
| R-factor | 0.161 |
| Rwork | 0.157 |
| R-free | 0.23300 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2Y4H |
| RMSD bond length | 0.023 |
| RMSD bond angle | 1.884 |
| 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] | 147.180 | 1.930 |
| High resolution limit [Å] | 1.830 | 1.830 |
| Rmerge | 0.080 | 0.560 |
| Number of reflections | 95693 | |
| <I/σ(I)> | 11.1 | 1.5 |
| Completeness [%] | 83.1 | 36.2 |
| Redundancy | 5.3 | 2.4 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 296 | 12% PEG MME 5000, 5% TACSIMATE PH 7.0, 1% BENZAMIDINE HYDROCHLORIDE, TEMP 23 C |
