6WG2
Crystal structure of Fab239 in complex with NPNA4 peptide from circumsporozoite protein
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | SSRL BEAMLINE BL12-2 |
| Synchrotron site | SSRL |
| Beamline | BL12-2 |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2019-06-13 |
| Detector | DECTRIS PILATUS3 S 6M |
| Wavelength(s) | 0.97946 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 82.166, 55.706, 115.732 |
| Unit cell angles | 90.00, 98.89, 90.00 |
Refinement procedure
| Resolution | 32.805 - 2.534 |
| R-factor | 0.1971 |
| Rwork | 0.195 |
| R-free | 0.24640 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | Homology model |
| RMSD bond length | 0.002 |
| RMSD bond angle | 0.565 |
| Data reduction software | HKL-2000 |
| Data scaling software | SCALEPACK |
| Phasing software | PHASER |
| Refinement software | PHENIX ((1.14_3260: ???)) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 2.580 |
| High resolution limit [Å] | 2.534 | 2.534 |
| Rpim | 0.082 | 0.522 |
| Number of reflections | 31852 | 1613 |
| <I/σ(I)> | 7.9 | 1.6 |
| Completeness [%] | 91.9 | 93.6 |
| Redundancy | 3.7 | 3.6 |
| CC(1/2) | 0.880 | 0.521 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 7 | 293.15 | 20% PEG6000, 0.1 M HEPES, pH 7.0 |
