Data DOI: 10.15785/SBGRID/91 | ID: 91
Publication DOI: 10.1126/science.1103596
1XBN Coordinates: Viewer, PDB (RCSB) (PDBe), MMDB
Raman Laboratory, University of Maryland
Release Date: 14 May 2015
1. If this dataset is locally available, it should be accessable at /programs/datagrid/91
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/91 .' (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/91 .' (Uppsala University, Sweden)
'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/91 .' (Institut Pasteur de Montevideo, Uruguay)
'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/91 .' (Shanghai Institutes for Biological Sciences, China)
3. After the transfer is completed, please issue the following command to verify data integrity:
'cd 91 ; shasum -c files.sha'
Storage requirements: 961M
Biological Sample:
Thermoanaerobacter tengcongensis SONO (H-NOX) in complex with dioxygen
Dataset Type:
X-Ray Diffraction
Subject Composition:
Protein
Collection Facility:
BL 8.3.1, Advanced Light Source, Berkeley, CA
Data Creation Date:
27 Feb 2004
Related Datasets:
Nioche, P; Raman, CS. 2015. "X-Ray Diffraction data for: Thermoanaerobacter tengcongensis SONO (H-NOX) in complex with dioxygen. PDB Code 1XBN", SBGrid Data Bank, V1, https://doi.org/10.15785/SBGRID/91.
Native data set collected at 11110.97 eV.
| Name | Additional Roles | Affiliation While Working on the Project |
|---|---|---|
| C S Raman | Data Collector, Depositor | University of Texas Medical School, Houston |
| Pierre Nioche | Data Collector | University of Texas Medical School, Houston |
| C S Raman | PI | University of Maryland |
This data was collected from a crystal that diffracts X-rays to a Bragg spacing of 2.5 A. Complete data set can be obtained by merging reflections from both low-res (mpd2lo) and high-res (mpd2hi) images. An independent archive of these images is maintained by Dr. James Holton (jmholton@lbl.gov) in the context of non-proprietary data collected at ALS beamline 8.3.1. If necessary, this dataset can be obtained directly from Dr. Holton.
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.11587
Sweep:
SWEEP1
Files:
/programs/datagrid/91/mpd2hi_1_###.img
Images:
12 - 26
Beam:
(115.05, 102.3) -> (115.05, 102.26)
Distance:
150.0 -> 149.41
Spacegroup:
P 42 3 2
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 2.25 | 6.07 | 2.25 |
| Low resolution limit | 22.39 | 22.39 | 2.29 |
| Completeness | 92.4 | 60.7 | 93.8 |
| Multiplicity | 3.5 | 3.3 | 3.5 |
| I/sigma | 11.7 | 34.0 | 1.0 |
| Rmerge | 0.042 | 0.025 | 1.41 |
| CC half | 0.998 | 0.996 | 0.315 |
| Anomalous completeness | 82.0 | 60.2 | 74.7 |
| Anomalous multiplicity | 2.1 | 2.1 | 2.1 |
| Cell | 120.59 | 120.59 | 120.59 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.11587
Sweep:
SWEEP1
Files:
/programs/datagrid/91/mpd2hi_1_###.img
Images:
12 - 26
Beam:
(115.05, 102.3) -> (115.05, 102.27)
Distance:
150.0 -> 149.52
Spacegroup:
P 42 3 2
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 2.24 | 6.06 | 2.24 |
| Low resolution limit | 26.31 | 26.31 | 2.28 |
| Completeness | 92.2 | 60.4 | 93.1 |
| Multiplicity | 3.5 | 3.3 | 3.4 |
| I/sigma | 11.6 | 34.1 | 1.3 |
| Rmerge | 0.042 | 0.025 | 1.149 |
| CC half | 0.998 | 0.996 | 0.47 |
| Anomalous completeness | 81.6 | 60.3 | 72.0 |
| Anomalous multiplicity | 2.0 | 2.0 | 2.0 |
| Cell | 120.58 | 120.58 | 120.58 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Reprocessing failed.
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.
