Data DOI: 10.15785/SBGRID/345 | ID: 345
Pai Laboratory, University of Toronto
Release Date: 16 Aug 2016
1. If this dataset is locally available, it should be accessable at /programs/datagrid/345
2. To download this dataset, please run the following command from your Terminal on a Linux or OS X workstation:
'rsync -av rsync://data.sbgrid.org/10.15785/SBGRID/345 .' (Harvard Medical School, USA)
Depending on your location, faster access may be available from a Tier 1 site closer to your location
'rsync -av rsync://sbgrid.icm.uu.se/10.15785/SBGRID/345 .' (Uppsala University, Sweden)
'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/345 .' (Institut Pasteur de Montevideo, Uruguay)
'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/345 .' (Shanghai Institutes for Biological Sciences, China)
3. After the transfer is completed, please issue the following command to verify data integrity:
'cd 345 ; shasum -c files.sha'
Storage requirements: 1.5G
Biological Sample:
Fluoroacetate dehalogenase
Dataset Type:
X-Ray Diffraction
Subject Composition:
Ligand, Protein
Collection Facility:
Home Source
Data Creation Date:
11 Nov 2013
Related Datasets:
None
Mehrabi, P; Pai, E. 2016. "X-Ray Diffraction data for: Fluoroacetate dehalogenase.", SBGrid Data Bank, V1, https://doi.org/10.15785/SBGRID/345.
Fluoroacetate dehalogenase cocrystallized with glycolate
| Name | Additional Roles | Affiliation While Working on the Project |
|---|---|---|
| Pedram Mehrabi | Data Collector, Depositor | PhD Student |
| Emil Pai | PI | University of Toronto |
none
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.54179
Sweep:
SWEEP1
Files:
/programs/datagrid/345/D110NGlyc_###.mar2300
Images:
1 - 500
Beam:
(172.5, 172.5) -> (172.5, 173.72)
Distance:
100.0 -> 98.96
Spacegroup:
P 1 21 1
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.54 | 4.17 | 1.54 |
| Low resolution limit | 22.61 | 22.61 | 1.57 |
| Completeness | 99.7 | 99.5 | 93.4 |
| Multiplicity | 9.5 | 10.0 | 5.9 |
| I/sigma | 22.6 | 37.6 | 4.6 |
| Rmerge | 0.063 | 0.055 | 0.4 |
| CC half | 0.998 | 0.997 | 0.957 |
| Anomalous completeness | 98.6 | 98.4 | 76.6 |
| Anomalous multiplicity | 4.8 | 4.8 | 4.8 |
| Cell | 41.89 | 79.0 | 84.99 | 90.0 | 103.23 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.54179
Sweep:
SWEEP1
Files:
/programs/datagrid/345/D110NGlyc_###.mar2300
Images:
1 - 500
Beam:
(172.5, 172.5) -> (172.5, 173.73)
Distance:
100.0 -> 98.85
Spacegroup:
P 1 21 1
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.54 | 4.17 | 1.54 |
| Low resolution limit | 26.33 | 26.34 | 1.57 |
| Completeness | 99.7 | 99.5 | 93.3 |
| Multiplicity | 9.5 | 10.0 | 5.9 |
| I/sigma | 22.6 | 37.5 | 4.6 |
| Rmerge | 0.063 | 0.055 | 0.4 |
| CC half | 0.998 | 0.997 | 0.958 |
| Anomalous completeness | 98.6 | 98.5 | 76.4 |
| Anomalous multiplicity | 4.8 | 4.8 | 4.8 |
| Cell | 41.89 | 79.0 | 84.99 | 90.0 | 103.23 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.54179
Sweep:
SWEEP1
Files:
/programs/datagrid/345/D110NGlyc_###.mar2300
Images:
1 - 500
Beam:
(172.5, 172.5) -> (172.5, 173.73)
Distance:
100.0 -> 98.98
Spacegroup:
P 1 21 1
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.48 | 4.02 | 1.48 |
| Low resolution limit | 28.58 | 28.58 | 1.51 |
| Completeness | 95.7 | 100.0 | 68.9 |
| Multiplicity | 9.0 | 10.3 | 6.7 |
| I/sigma | 19.8 | 34.5 | -0.2 |
| Rmerge | 0.106 | 0.081 | -1.279 |
| CC half | 0.99 | 0.988 | 0.294 |
| Anomalous completeness | 93.3 | 99.7 | 67.4 |
| Anomalous multiplicity | 4.6 | 4.6 | 4.6 |
| Cell | 41.908 | 79.009 | 85.037 | 90.0 | 103.218 | 90.0 |
|---|
License: CC0
Terms: Our Community Norms as well as good scientific practices expect that proper credit is given via citation. Please use the data citation, as generated by the SBGrid Data Bank.