4M1A
Crystal structure of a Domain of unknown function (DUF1904) from Sebaldella termitidis ATCC 33386
Experimental procedure
Experimental method | SINGLE WAVELENGTH |
Source type | SYNCHROTRON |
Source details | NSLS BEAMLINE X29A |
Synchrotron site | NSLS |
Beamline | X29A |
Temperature [K] | 100 |
Detector technology | CCD |
Collection date | 2013-07-24 |
Detector | ADSC QUANTUM 315r |
Wavelength(s) | 0.979 |
Spacegroup name | P 3 |
Unit cell lengths | 90.283, 90.283, 37.099 |
Unit cell angles | 90.00, 90.00, 120.00 |
Refinement procedure
Resolution | 45.180 - 1.900 |
R-factor | 0.17732 |
Rwork | 0.176 |
R-free | 0.20551 |
Structure solution method | SAD |
RMSD bond length | 0.023 |
RMSD bond angle | 2.128 |
Data reduction software | HKL-2000 |
Data scaling software | HKL-2000 |
Phasing software | SHELXD |
Refinement software | REFMAC (5.7.0029) |
Data quality characteristics
Overall | Outer shell | |
Low resolution limit [Å] | 50.000 | 1.960 |
High resolution limit [Å] | 1.900 | 1.900 |
Rmerge | 0.053 | 0.203 |
Number of reflections | 25228 | |
<I/σ(I)> | 22.1 | 2 |
Completeness [%] | 94.7 | 66.6 |
Redundancy | 11.1 | 9.3 |
Crystallization Conditions
crystal ID | method | pH | temperature | details |
1 | VAPOR DIFFUSION, SITTING DROP | 5.5 | 298 | 0.2M Ammonium acetate 0.1M Bis-Tris 45% 2-Methyl-2,4-pentanediol, pH 5.5, VAPOR DIFFUSION, SITTING DROP, temperature 298K |