4ZC6
Crystal Structure of human GGT1 in complex with Serine Borate
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | SSRL BEAMLINE BL14-1 |
Synchrotron site | SSRL |
Beamline | BL14-1 |
Temperature [K] | 100 |
Detector technology | PIXEL |
Collection date | 2014-12-03 |
Detector | DECTRIS PILATUS 6M |
Wavelength(s) | 0.979 |
Spacegroup name | C 2 2 21 |
Unit cell lengths | 105.182, 124.360, 103.613 |
Unit cell angles | 90.00, 90.00, 90.00 |
Refinement procedure
Resolution | 80.310 - 2.100 |
R-factor | 0.1768 |
Rwork | 0.175 |
R-free | 0.21790 |
Structure solution method | FOURIER SYNTHESIS |
Starting model (for MR) | 4z9o |
RMSD bond length | 0.011 |
RMSD bond angle | 1.448 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | REFMAC (5.8.0073) |
Refinement software | REFMAC (5.8.0073) |
Data quality characteristics
Overall | Inner shell | Outer shell | |
Low resolution limit [Å] | 100.000 | 100.000 | 2.140 |
High resolution limit [Å] | 2.100 | 5.700 | 2.100 |
Rmerge | 0.152 | 0.064 | 0.634 |
Rmeas | 0.166 | 0.070 | 0.701 |
Rpim | 0.063 | 0.027 | 0.283 |
Total number of observations | 241835 | ||
Number of reflections | 38155 | ||
<I/σ(I)> | 5.3 | ||
Completeness [%] | 95.5 | 95.2 | 77 |
Redundancy | 6.3 | 6.4 | 4.8 |
CC(1/2) | 0.995 | 0.689 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, HANGING DROP | 6 | 298 | PEG3350, NH4Cl |