Data DOI: 10.15785/SBGRID/281 | ID: 281
Publication DOI: 10.1021/bi300957f
4EUD Coordinates: Viewer, PDB (RCSB) (PDBe), MMDB
Kappock Laboratory, Purdue University
Release Date: May 27, 2016
1. If this dataset is locally available, it should be accessable at /programs/datagrid/281
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/281 .' (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/281 .' (Uppsala University, Sweden)
'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/281 .' (Institut Pasteur de Montevideo, Uruguay)
'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/281 .' (Shanghai Institutes for Biological Sciences, China)
3. After the transfer is completed, please issue the following command to verify data integrity:
'cd 281 ; shasum -c files.sha'
Storage requirements: 12G
Biological Sample:
succinyl-CoA:acetate CoA-transferase (EC 2.8.3.18) bound to CoA and citrate
Dataset Type:
X-Ray Diffraction
Subject Composition:
Ligand, Protein
Collection Facility:
beamline 23-ID-B, GM/CA, APS, Chicago, IL
Data Creation Date:
July 2, 2010
Related Datasets:
None
Mullins, EA.; Kappock, T. 2016. "X-Ray Diffraction data for: succinyl-CoA:acetate CoA-transferase (EC 2.8.3.18) bound to CoA and citrate. PDB Code 4EUD", SBGrid Data Bank, V1, https://doi.org/10.15785/SBGRID/281.
Succinyl-CoA:acetate CoA-transferase (AarC) in complex with CoA and citrate
| Name | Additional Roles | Affiliation While Working on the Project |
|---|---|---|
| Elwood A. Mullins | Data Collector | Purdue University |
| T. Joseph Kappock | Depositor, PI | Purdue University |
none
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.0332
Sweep:
SWEEP1
Files:
/programs/datagrid/281/aarc_70_1.####
Images:
1 - 360
Beam:
(150.0, 150.0) -> (150.0, 150.32)
Distance:
250.0 -> 251.12
Spacegroup:
P 1
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 2.15 | 5.83 | 2.15 |
| Low resolution limit | 67.81 | 67.84 | 2.19 |
| Completeness | 96.5 | 98.6 | 94.4 |
| Multiplicity | 3.9 | 4.0 | 3.8 |
| I/sigma | 5.7 | 9.7 | 3.0 |
| Rmerge | 0.313 | 0.083 | 0.958 |
| CC half | 0.885 | 0.968 | 0.281 |
| Anomalous completeness | 94.6 | 98.2 | 90.4 |
| Anomalous multiplicity | 1.9 | 1.9 | 1.9 |
| Cell | 67.806 | 111.023 | 119.951 | 90.244 | 90.006 | 90.152 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.0332
Sweep:
SWEEP1
Files:
/programs/datagrid/281/aarc_70_1.####
Images:
1 - 360
Beam:
(150.0, 150.0) -> (150.0, 150.2)
Distance:
250.0 -> 249.38
Spacegroup:
P 21 21 21
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.86 | 5.05 | 1.86 |
| Low resolution limit | 52.54 | 52.56 | 1.89 |
| Completeness | 99.0 | 100.0 | 87.0 |
| Multiplicity | 13.9 | 13.1 | 11.4 |
| I/sigma | 8.9 | 26.5 | 1.0 |
| Rmerge | 0.406 | 0.086 | 2.458 |
| CC half | 0.987 | 0.996 | 0.412 |
| Anomalous completeness | 98.9 | 99.9 | 87.1 |
| Anomalous multiplicity | 7.2 | 7.2 | 7.2 |
| Cell | 67.64 | 110.3 | 119.52 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.0332
Sweep:
SWEEP1
Files:
/programs/datagrid/281/aarc_70_1.####
Images:
1 - 360
Beam:
(150.0, 150.0) -> (150.0, 150.21)
Distance:
250.0 -> 250.56
Spacegroup:
P 21 21 21
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 1.87 | 5.07 | 1.87 |
| Low resolution limit | 57.65 | 57.68 | 1.9 |
| Completeness | 99.3 | 100.0 | 88.6 |
| Multiplicity | 13.9 | 13.0 | 11.7 |
| I/sigma | 9.1 | 26.5 | 1.1 |
| Rmerge | 0.4 | 0.085 | 2.264 |
| CC half | 0.987 | 0.996 | 0.416 |
| Anomalous completeness | 99.1 | 100.0 | 88.7 |
| Anomalous multiplicity | 7.3 | 7.3 | 7.3 |
| Cell | 67.63 | 110.29 | 119.51 | 90.0 | 90.0 | 90.0 |
|---|
Version:
version unreported
Project:
AUTOMATIC
Crystal:
DEFAULT
Sequence Length:
0
Wavelength:
SAD - 1.0332
Sweep:
SWEEP1
Files:
/programs/datagrid/281/aarc_70_1.####
Images:
1 - 360
Beam:
(150.0, 150.0) -> (150.0, 150.29)
Distance:
250.0 -> 244.5
Spacegroup:
P 1
For AUTOMATIC/DEFAULT/SAD:
| ALL | LOW | HIGH | |
|---|---|---|---|
| High resolution limit | 2.33 | 6.32 | 2.33 |
| Low resolution limit | 80.06 | 80.1 | 2.37 |
| Completeness | 97.3 | 99.6 | 74.7 |
| Multiplicity | 4.0 | 4.0 | 3.9 |
| I/sigma | 5.3 | 8.2 | 3.2 |
| Rmerge | 0.36 | 0.083 | 2.163 |
| CC half | 0.885 | 0.978 | 0.269 |
| Anomalous completeness | 97.1 | 99.4 | 74.3 |
| Anomalous multiplicity | 2.0 | 2.0 | 2.0 |
| Cell | 66.655 | 108.596 | 118.148 | 89.852 | 89.891 | 89.933 |
|---|
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.
