5KMC
Human Histidine Triad Nucleotide Binding Protein 1 (hHint1) non-nucleotidic covalent intermediate complex
Experimental procedure
| Experimental method | SINGLE WAVELENGTH |
| Source type | SYNCHROTRON |
| Source details | ALS BEAMLINE 4.2.2 |
| Synchrotron site | ALS |
| Beamline | 4.2.2 |
| Temperature [K] | 100 |
| Detector technology | CMOS |
| Collection date | 2015-09-24 |
| Detector | RDI CMOS_8M |
| Wavelength(s) | 1.000 |
| Spacegroup name | C 1 2 1 |
| Unit cell lengths | 78.093, 46.151, 63.994 |
| Unit cell angles | 90.00, 94.66, 90.00 |
Refinement procedure
| Resolution | 39.697 - 1.350 |
| R-factor | 0.1593 |
| Rwork | 0.159 |
| R-free | 0.17440 |
| Structure solution method | MOLECULAR REPLACEMENT |
| Starting model (for MR) | 3tw2 |
| RMSD bond length | 0.005 |
| RMSD bond angle | 1.019 |
| Data reduction software | XDS |
| Data scaling software | Aimless (0.5.9) |
| Phasing software | PHASER (2.6.0) |
| Refinement software | PHENIX |
Data quality characteristics
| Overall | Inner shell | Outer shell | |
| Low resolution limit [Å] | 39.700 | 39.700 | 1.370 |
| High resolution limit [Å] | 1.350 | 7.390 | 1.350 |
| Rmerge | 0.044 | 0.019 | 0.384 |
| Rmeas | 0.052 | ||
| Rpim | 0.027 | ||
| Total number of observations | 173639 | ||
| Number of reflections | 47786 | ||
| <I/σ(I)> | 19.2 | ||
| Completeness [%] | 95.9 | 93.9 | 91 |
| Redundancy | 3.6 | 3.4 | 3.4 |
| CC(1/2) | 0.999 |
Crystallization Conditions
| crystal ID | method | pH | temperature | details |
| 1 | VAPOR DIFFUSION, HANGING DROP | 6.1 | 293 | 100 mM MES, 39% PEG 8000, |
