8GU1
Crystal Structure of putative amino acid binding periplasmic ABC transporter protein from Candidatus Liberibacter asiaticus in complex with Pimozide
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | ROTATING ANODE |
| Source details | RIGAKU MICROMAX-007 HF |
| Temperature [K] | 100 |
| Detector technology | PIXEL |
| Collection date | 2021-11-17 |
| Detector | RIGAKU HyPix-6000HE |
| Wavelength(s) | 1.54 |
| Spacegroup name | P 1 21 1 |
| Unit cell lengths | 90.014, 45.795, 115.675 |
| Unit cell angles | 90.00, 91.99, 90.00 |
Refinement procedure
| Resolution | 28.800 - 2.650 |
| R-factor | 0.2392 |
| Rwork | 0.237 |
| R-free | 0.28280 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 6a80 |
| RMSD bond length | 0.008 |
| RMSD bond angle | 1.932 |
| Data reduction software | CrysalisPro |
| Data scaling software | Aimless |
| Phasing software | MOLREP |
| Refinement software | REFMAC (5.8.0267) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 28.800 | 9.010 |
| High resolution limit [Å] | 2.650 | 2.650 |
| Number of reflections | 29525 | 3590 |
| <I/σ(I)> | 5.5 | |
| Completeness [%] | 99.8 | |
| Redundancy | 4.3 | |
| CC(1/2) | 0.970 | 0.860 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, SITTING DROP | 293 | 0.1M Sodium citrate, 20% PEG 550, pH 5 |
