4UNL
Crystal structure of a single mutant (N71D) of triosephosphate isomerase from human
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | APS BEAMLINE 21-ID-F |
| Synchrotron site | APS |
| Beamline | 21-ID-F |
| Temperature [K] | 90 |
| Detector technology | CCD |
| Collection date | 2010-07-28 |
| Detector | MARRESEARCH |
| Spacegroup name | P 21 21 21 |
| Unit cell lengths | 64.943, 72.841, 93.302 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 39.280 - 1.500 |
| R-factor | 0.2001 |
| Rwork | 0.199 |
| R-free | 0.22564 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 2jk2 |
| RMSD bond length | 0.006 |
| RMSD bond angle | 1.025 |
| Data reduction software | MOSFLM |
| Data scaling software | SCALA |
| Phasing software | PHASER (FOR MR) |
| Refinement software | REFMAC (5.5.0109) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 39.280 | 1.540 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.060 | 0.490 |
| Number of reflections | 71346 | |
| <I/σ(I)> | 7.2 | 2.5 |
| Completeness [%] | 99.7 | 98.6 |
| Redundancy | 2 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | 5.6 | PROTEIN WAS CRYSTALLIZED FROM: 0.2 M AMMONIUM ACETATE, 0.1 M SODIUM CITRATE TRIBASIC DIHYDRATE PH 5.6, 30% W/V POLYETHYLENE GLYCOL 4,000 |
