4AJE
rat LDHA in complex with 2-(4-bromophenoxy)propanedioic acid
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU FR-E |
| Temperature [K] | 100 |
| Detector technology | CCD |
| Collection date | 2009-10-06 |
| Detector | RIGAKU SATURN 944 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 62.298, 82.510, 129.113 |
| Unit cell angles | 90.00, 96.19, 90.00 |
Refinement procedure
| Resolution | 28.990 - 2.350 |
| R-factor | 0.20544 |
| Rwork | 0.202 |
| R-free | 0.27180 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | INTERNAL RAT LDHA STRUCTURE |
| RMSD bond length | 0.012 |
| RMSD bond angle | 1.483 |
| Data reduction software | d*TREK |
| Data scaling software | d*TREK |
| Phasing software | AMoRE |
| Refinement software | REFMAC (5.6.0117) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 30.870 | 2.430 |
| High resolution limit [Å] | 2.350 | 2.350 |
| Rmerge | 0.090 | 0.300 |
| Number of reflections | 54228 | |
| <I/σ(I)> | 8.3 | 2.7 |
| Completeness [%] | 99.8 | 99.6 |
| Redundancy | 3.44 | 3.48 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 7 | 1.5 M NA MALONATE PH 7.0, 2% GLYCEROL |
