4CJ2
Crystal structure of HEWL in complex with affitin H4
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ESRF |
| Synchrotron site | ESRF |
| Beamline | ID14-4 |
| Temperature [K] | 100 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 37.889, 62.813, 87.099 |
| Unit cell angles | 90.00, 98.75, 90.00 |
Refinement procedure
| Resolution | 43.080 - 1.500 |
| R-factor | 0.13879 |
| Rwork | 0.137 |
| R-free | 0.17811 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1gwd |
| RMSD bond length | 0.020 |
| RMSD bond angle | 1.884 |
| Data reduction software | XDS |
| Data scaling software | Aimless |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 43.050 | 1.580 |
| High resolution limit [Å] | 1.500 | 1.500 |
| Rmerge | 0.040 | 0.370 |
| Number of reflections | 62347 | |
| <I/σ(I)> | 17.1 | 3.2 |
| Completeness [%] | 96.3 | 95 |
| Redundancy | 3.5 | 3.5 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 |
