7C1I
Crystal structure of histidine-containing phosphotransfer protein B (HptB) from Pseudomonas aeruginosa PAO1
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | NSRRC BEAMLINE BL15A1 |
| Synchrotron site | NSRRC |
| Beamline | BL15A1 |
| Temperature [K] | 110 |
| Detector technology | CCD |
| Collection date | 2017-04-08 |
| Detector | RAYONIX MX300HE |
| Wavelength(s) | 1.0 |
| Spacegroup name | P 43 21 2 |
| Unit cell lengths | 119.172, 119.172, 171.950 |
| Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
| Resolution | 29.370 - 1.580 |
| R-factor | 0.19447 |
| Rwork | 0.193 |
| R-free | 0.22542 |
| Structure solution method | MAD |
| RMSD bond length | 0.001 |
| RMSD bond angle | 3.085 |
| Data reduction software | HKL-2000 |
| Data scaling software | HKL-2000 |
| Phasing software | PHASER |
| Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
| Overall | Outer shell | |
| Low resolution limit [Å] | 50.000 | 1.640 |
| High resolution limit [Å] | 1.580 | 1.580 |
| Rmerge | 0.072 | 0.761 |
| Rmeas | 0.075 | 0.789 |
| Rpim | 0.020 | 0.208 |
| Number of reflections | 166104 | 16599 |
| <I/σ(I)> | 36.3 | 4.2 |
| Completeness [%] | 98.4 | 99.6 |
| Redundancy | 14.5 | 14.3 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 291 | PEG 6000, bicine/sodium hydroxide |
