4LVO
Crystal structure of PfSUB1-prodomain-NIMP.M7 Fab complex with added CaCl2
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | DIAMOND BEAMLINE I04-1 |
| Synchrotron site | Diamond |
| Beamline | I04-1 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2013-05-30 |
| Detector | DECTRIS PILATUS 2M |
| Wavelength(s) | 0.92 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 73.340, 76.030, 77.880 |
| Unit cell angles | 90.00, 102.03, 90.00 |
Refinement procedure
| Resolution | 29.340 - 2.260 |
| R-factor | 0.1936 |
| Rwork | 0.191 |
| R-free | 0.23650 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 1BH6 AND 1MLC |
| RMSD bond length | 0.004 |
| RMSD bond angle | 0.900 |
| Data reduction software | XDS |
| Data scaling software | XDS |
| Phasing software | PHENIX (autoMR) |
| Refinement software | PHENIX ((phenix.refine: 1.8.2_1309)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 76.170 | 2.340 |
| High resolution limit [Å] | 2.260 | 2.260 |
| Rmerge | 0.085 | 0.501 |
| Number of reflections | 38421 | |
| <I/σ(I)> | 11.69 | 2.16 |
| Completeness [%] | 97.6 | 91.69 |
| Redundancy | 3.4 | 3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 8.5 | 291.15 | 20% PEG 3350, 0.2M ammonium formate, 150mM NaCl, 40mM CaCl2, pH 8.5, VAPOR DIFFUSION, SITTING DROP, temperature 291.15K |
