6YQM
Human histidine triad nucleotide-binding protein 1 (hHINT1) complexed with dGMP and refined to 1.02 A
This is a non-PDB format compatible entry.
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | BESSY BEAMLINE 14.2 |
Synchrotron site | BESSY |
Beamline | 14.2 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2020-03-07 |
Detector | DECTRIS PILATUS3 2M |
Wavelength(s) | 0.9184 |
Spacegroup name | C 1 2 1 |
Unit cell lengths | 78.658, 46.434, 64.102 |
Unit cell angles | 90.00, 94.24, 90.00 |
Refinement procedure
Resolution | 39.960 - 1.020 |
Rwork | 0.112 |
R-free | 0.13560 |
Structure solution method | MOLECULAR REPLACEMENT |
Starting model (for MR) | 3tw2 |
RMSD bond length | 0.026 |
RMSD bond angle | 2.403 |
Data reduction software | XDS |
Data scaling software | Aimless (0.7.4) |
Phasing software | MOLREP (11.7.02) |
Refinement software | REFMAC (5.8.0258) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 39.963 | 1.040 |
High resolution limit [Å] | 1.020 | 1.020 |
Rmerge | 0.042 | 0.466 |
Rmeas | 0.056 | 0.630 |
Rpim | 0.037 | 0.422 |
Number of reflections | 116020 | 5440 |
<I/σ(I)> | 14.1 | 2.1 |
Completeness [%] | 99.1 | 93.6 |
Redundancy | 3.8 | 3.3 |
CC(1/2) | 0.999 | 0.785 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 5.7 | 281 | 16 % (w/v) PEG 4000, 0.1 M sodium cacodylate |