4REQ
Methylmalonyl-COA Mutase substrate complex
Experimental procedure
| Source type | SYNCHROTRON |
| Source details | ELETTRA BEAMLINE 5.2R |
| Synchrotron site | ELETTRA |
| Beamline | 5.2R |
| Temperature [K] | 95 |
| Detector technology | IMAGE PLATE AREA DETECTOR |
| Collection date | 1995-09 |
| Detector | MARRESEARCH |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 120.130, 160.900, 88.500 |
| Unit cell angles | 90.00, 104.64, 90.00 |
Refinement procedure
| Resolution | 20.000 - 2.200 |
| R-factor | 0.232 |
| Rwork | 0.222 |
| R-free | 0.27700 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1req |
| RMSD bond length | 0.012 |
| RMSD bond angle | 0.043 |
| Data reduction software | MOSFLM |
| Data scaling software | CCP4 ((SCALA)) |
| Phasing software | AMoRE |
| Refinement software | REFMAC |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 20.000 | 2.320 |
| High resolution limit [Å] | 2.200 | 2.200 |
| Rmerge | 0.103 | 0.379 |
| Number of reflections | 164181 | |
| <I/σ(I)> | 5.3 | 1.6 |
| Completeness [%] | 99.8 | 99.9 |
| Redundancy | 4.3 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7.5 | pH 7.5 |
