X-Ray Diffraction data from Fluoroacetate dehalogenase, source of structure

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Data DOI: 10.15785/SBGRID/343 | ID: 343

Pai Laboratory, University of Toronto

Release Date: 16 Aug 2016

Data Access Instructions

1. If this dataset is locally available, it should be accessable at /programs/datagrid/343

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/343 .' (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/343 .' (Uppsala University, Sweden)

'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/343 .' (Institut Pasteur de Montevideo, Uruguay)

'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/343 .' (Shanghai Institutes for Biological Sciences, China)

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

'cd 343 ; shasum -c files.sha'

Storage requirements: 606M

Biological Sample:

Fluoroacetate dehalogenase

Dataset Type:

X-Ray Diffraction

Subject Composition:

Protein

Collection Facility:

Home Source

Data Creation Date:

15 Mar 2013

Related Datasets:

None


Cite this Dataset

Mehrabi, P; Pai, E. 2016. "X-Ray Diffraction data for: Fluoroacetate dehalogenase.", SBGrid Data Bank, V1, http://dx.doi.org/10.15785/SBGRID/343.

Download Citation

Dataset Description

Fluoroacetate dehalogenase with 5'-F-tryptophans

Project Members

Name Additional Roles Affiliation While Working on the Project
Pedram MehrabiData Collector, DepositorPhD Student
Emil PaiPIUniversity of Toronto

Reprocessing Instructions

none

Reprocessing Data

About Reprocessing

Version:

version unreported

Reprocessing failed.

Version:

version unreported

Project:

AUTOMATIC

Crystal:

DEFAULT

Sequence Length:

0

Wavelength:

SAD - 1.54179

Sweep:

SWEEP1

Files:

/programs/datagrid/343/F-Trp-RPA1163_###.mar2300

Images:

1 - 200

Beam:

(172.5, 172.5) -> (172.5, 173.73)

Distance:

100.0 -> 102.52

Spacegroup:

P 1 21 1

For AUTOMATIC/DEFAULT/SAD:

ALL LOW HIGH
High resolution limit 1.88 5.09 1.88
Low resolution limit 29.04 29.04 1.91
Completeness 91.2 97.6 92.7
Multiplicity 3.5 3.9 3.8
I/sigma 12.3 25.4 1.1
Rmerge 0.067 0.033 1.158
CC half 0.984 0.993 0.423
Anomalous completeness 68.3 90.2 79.1
Anomalous multiplicity 2.0 2.0 2.0
Cell 42.96 81.52 87.41 90.0 102.65 90.0

Version:

version unreported

Reprocessing failed.

Version:

version unreported

Project:

AUTOMATIC

Crystal:

DEFAULT

Sequence Length:

0

Wavelength:

SAD - 1.54179

Sweep:

SWEEP1

Files:

/programs/datagrid/343/F-Trp-RPA1163_###.mar2300

Images:

1 - 200

Beam:

(172.5, 172.5) -> (172.5, 173.71)

Distance:

100.0 -> 98.95

Spacegroup:

P 1 21 1

For AUTOMATIC/DEFAULT/SAD:

ALL LOW HIGH
High resolution limit 1.54 4.18 1.54
Low resolution limit 36.29 36.3 1.57
Completeness 97.0 99.1 77.3
Multiplicity 3.9 4.0 2.1
I/sigma 10.0 18.7 2.7
Rmerge 0.061 0.04 0.323
CC half 0.995 0.994 0.799
Anomalous completeness 86.8 97.6 39.2
Anomalous multiplicity 2.1 2.1 2.1
Cell 41.87 79.421 85.231 90.0 103.009 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.