Data DOI: 10.15785/SBGRID/282 | ID: 282
Publication DOI: 10.3389/fchem.2016.00023
5DDK Coordinates: Viewer, PDB (RCSB) (PDBe), MMDB
Kappock Laboratory, Purdue University
Release Date: 27 May 2016
1. If this dataset is locally available, it should be accessable at /programs/datagrid/282
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/282 .' (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/282 .' (Uppsala University, Sweden)
'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/282 .' (Institut Pasteur de Montevideo, Uruguay)
'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/282 .' (Shanghai Institutes for Biological Sciences, China)
3. After the transfer is completed, please issue the following command to verify data integrity:
'cd 282 ; shasum -c files.sha'
Storage requirements: 12G
Biological Sample:
succinyl-CoA:acetate CoA-transferase (EC 2.8.3.18), N347A mutant bound to CoA
Dataset Type:
X-Ray Diffraction
Subject Composition:
Ligand, Protein
Collection Facility:
21-ID-G, LS-CAT, APS, Chicago, IL
Data Creation Date:
27 Jun 2012
Related Datasets:
None
Mullins, EA.; Murphy, JR.; Kappock, T. 2016. "X-Ray Diffraction data for: succinyl-CoA:acetate CoA-transferase (EC 2.8.3.18), N347A mutant bound to CoA. PDB Code 5DDK", SBGrid Data Bank, V1, https://doi.org/10.15785/SBGRID/282.
Succinyl-CoA:acetate CoA-transferase (AarCH6-N347A) in complex with CoA
| Name | Additional Roles | Affiliation While Working on the Project |
|---|---|---|
| Elwood A. Mullins | Purdue University | |
| Jesse R. Murphy | Purdue University | |
| T. Joseph Kappock | Data Collector, Depositor, PI | Purdue University |
none
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 0.97856
Sweep:
SWEEP2
Files:
/programs/datagrid/282/AarC_7_1.###
Images:
1 - 180
Beam:
(145.75, 155.62) -> (145.75, 155.52)
Distance:
200.0 -> 199.35
Spacegroup:
P 21 21 21
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.77 | 4.8 | 1.77 |
| Low resolution limit | 41.41 | 41.42 | 1.8 |
| Completeness | 99.9 | 100.0 | 99.7 |
| Multiplicity | 14.7 | 13.8 | 14.8 |
| I/sigma | 15.5 | 58.8 | 1.0 |
| Rmerge | 0.163 | 0.032 | 3.215 |
| CC half | 0.999 | 1.0 | 0.431 |
| Anomalous completeness | 99.8 | 99.9 | 99.7 |
| Anomalous multiplicity | 7.7 | 7.7 | 7.7 |
| Cell | 67.05 | 109.67 | 120.02 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 0.97856
Sweep:
SWEEP2
Files:
/programs/datagrid/282/AarC_7_1.###
Images:
1 - 180
Beam:
(145.75, 155.62) -> (145.75, 155.52)
Distance:
200.0 -> 199.52
Spacegroup:
P 21 21 21
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.77 | 4.8 | 1.77 |
| Low resolution limit | 57.21 | 57.24 | 1.8 |
| Completeness | 99.9 | 100.0 | 99.7 |
| Multiplicity | 14.7 | 13.8 | 14.8 |
| I/sigma | 15.5 | 58.7 | 1.0 |
| Rmerge | 0.163 | 0.032 | 3.21 |
| CC half | 0.999 | 1.0 | 0.429 |
| Anomalous completeness | 99.9 | 99.9 | 99.6 |
| Anomalous multiplicity | 7.7 | 7.7 | 7.7 |
| Cell | 67.05 | 109.67 | 120.02 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 0.97856
Sweep:
SWEEP2
Files:
/programs/datagrid/282/AarC_7_1.###
Images:
1 - 180
Beam:
(145.75, 155.62) -> (145.75, 155.61)
Distance:
200.0 -> 199.35
Spacegroup:
P 2 2 2
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.52 | 4.13 | 1.52 |
| Low resolution limit | 119.9 | 120.27 | 1.55 |
| Completeness | 99.8 | 100.0 | 98.7 |
| Multiplicity | 13.8 | 13.6 | 12.2 |
| I/sigma | 24.0 | 27.1 | 21.2 |
| Rmerge | 0.174 | 0.172 | 0.165 |
| CC half | 0.941 | 0.986 | 0.532 |
| Anomalous completeness | 99.8 | 100.0 | 98.0 |
| Anomalous multiplicity | 7.1 | 7.1 | 7.1 |
| Cell | 66.971 | 109.676 | 119.899 | 90.0 | 90.0 | 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.
