X-Ray Diffraction data from succinyl-CoA:acetate CoA-transferase (EC 2.8.3.18), E294A mutant bound to dethiaacetyl-CoA, source of 4EUC structure

Data DOI: 10.15785/SBGRID/280 | ID: 280

Publication DOI: 10.1021/bi300957f

4EUC Coordinates: Viewer, PDB (RCSB) (PDBe), MMDB

Kappock Laboratory, Purdue University

Release Date: May 31, 2016

Data Access Instructions

1. If this dataset is locally available, it should be accessable at /programs/datagrid/280

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/280 .' (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/280 .' (Uppsala University, Sweden)

'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/280 .' (Institut Pasteur de Montevideo, Uruguay)

'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/280 .' (Shanghai Institutes for Biological Sciences, China)

3. After the transfer is completed, please issue the following command to verify data integrity:

'cd 280 ; shasum -c files.sha'

Storage requirements: 12G

Biological Sample:

succinyl-CoA:acetate CoA-transferase (EC 2.8.3.18), E294A mutant bound to dethiaacetyl-CoA

Dataset Type:

X-Ray Diffraction

Subject Composition:

Ligand, Protein

Collection Facility:

beamline 21-ID-G, LS-CAT, APS, Chicago, IL

Data Creation Date:

Dec. 3, 2011

Related Datasets:

None


Cite this Dataset

Mullins, EA.; Kappock, T. 2016. "X-Ray Diffraction data for: succinyl-CoA:acetate CoA-transferase (EC 2.8.3.18), E294A mutant bound to dethiaacetyl-CoA. PDB Code 4EUC", SBGrid Data Bank, V1, https://doi.org/10.15785/SBGRID/280.

Download Citation

Dataset Description

Succinyl-CoA:acetate CoA-transferase (AarCH6-E294A) in complex with dethiaacetyl-CoA

Project Members

Name Additional Roles Affiliation While Working on the Project
Elwood A. MullinsData CollectorPurdue University
T. Joseph KappockDepositor, PIPurdue University

Reprocessing Instructions

none

Reprocessing Data

About Reprocessing

Version:

version unreported

Reprocessing failed.

Version:

version unreported

Project:

AUTOMATIC

Crystal:

DEFAULT

Sequence Length:

0

Wavelength:

SAD - 0.97856

Sweep:

SWEEP1

Files:

/programs/datagrid/280/dethia3A.###

Images:

1 - 360

Beam:

(145.75, 155.62) -> (145.75, 155.57)

Distance:

200.0 -> 199.31

Spacegroup:

P 21 21 21

For AUTOMATIC/DEFAULT/SAD:

ALL LOW HIGH
High resolution limit 1.95 5.29 1.95
Low resolution limit 43.53 43.54 1.98
Completeness 100.0 100.0 100.0
Multiplicity 14.8 13.3 14.9
I/sigma 11.8 42.4 1.0
Rmerge 0.29 0.05 3.222
CC half 0.997 0.999 0.439
Anomalous completeness 100.0 99.9 100.0
Anomalous multiplicity 7.7 7.7 7.7
Cell 79.5 104.04 120.06 90.0 90.0 90.0

Version:

version unreported

Project:

AUTOMATIC

Crystal:

DEFAULT

Sequence Length:

0

Wavelength:

SAD - 0.97856

Sweep:

SWEEP1

Files:

/programs/datagrid/280/dethia3A.###

Images:

1 - 360

Beam:

(145.75, 155.62) -> (145.75, 155.56)

Distance:

200.0 -> 199.43

Spacegroup:

P 21 21 21

For AUTOMATIC/DEFAULT/SAD:

ALL LOW HIGH
High resolution limit 1.96 5.32 1.96
Low resolution limit 63.17 63.2 1.99
Completeness 100.0 100.0 100.0
Multiplicity 14.8 13.2 14.9
I/sigma 12.0 42.4 1.0
Rmerge 0.287 0.05 3.157
CC half 0.997 0.999 0.389
Anomalous completeness 100.0 99.9 100.0
Anomalous multiplicity 7.7 7.7 7.7
Cell 79.5 104.04 120.06 90.0 90.0 90.0

Version:

version unreported

Project:

AUTOMATIC

Crystal:

DEFAULT

Sequence Length:

0

Wavelength:

SAD - 0.97856

Sweep:

SWEEP1

Files:

/programs/datagrid/280/dethia3A.###

Images:

1 - 360

Beam:

(145.75, 155.62) -> (145.75, 155.65)

Distance:

200.0 -> 199.26

Spacegroup:

P 21 21 21

For AUTOMATIC/DEFAULT/SAD:

ALL LOW HIGH
High resolution limit 2.06 5.59 2.06
Low resolution limit 51.99 52.0 2.09
Completeness 100.0 100.0 98.3
Multiplicity 14.8 13.7 14.9
I/sigma 10.2 26.4 1.6
Rmerge 0.258 0.062 4.913
CC half 0.998 0.999 0.798
Anomalous completeness 99.9 100.0 98.3
Anomalous multiplicity 7.8 7.8 7.8
Cell 79.504 103.972 120.05 90.0 90.0 90.0

License and Terms of use

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.