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X-Ray Diffraction data from Xcc4156, a flavin-dependent halogenase from Xanthomonas campestris, source of 6Y1W structure

Data DOI: 10.15785/SBGRID/986 | ID: 986

Publication DOI: 10.1107/S2059798320007731

6Y1W Coordinates: Viewer, PDB (RCSB) (PDBe), MMDB

Niemann Laboratory, Bielefeld University

Release Date: Jan. 18, 2023

Data Access Instructions

1. If this dataset is locally available, it should be accessable at /programs/datagrid/986

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/986 .' (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/986 .' (Uppsala University, Sweden)

'rsync -av rsync://sbgrid.pasteur.edu.uy/10.15785/SBGRID/986 .' (Institut Pasteur de Montevideo, Uruguay)

'rsync -av rsync://sbgrid.ncpss.org/10.15785/SBGRID/986 .' (Shanghai Institutes for Biological Sciences, China)

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

'cd 986 ; shasum -c files.sha'

Storage requirements: 8.4G

Biological Sample:

Xcc4156, a flavin-dependent halogenase from Xanthomonas campestris

Dataset Type:

X-Ray Diffraction

Subject Composition:

Protein

Collection Facility:

beamline BL14.2, BESSY II, Helmholtz-Zentrum Berlin fuer Materialien und Energie

Data Creation Date:

March 8, 2017

Related Datasets:

None


Cite this Dataset

Buss, M; Niemann, HH. 2023. "X-Ray Diffraction data for: Xcc4156, a flavin-dependent halogenase from Xanthomonas campestris. PDB Code 6Y1W", SBGrid Data Bank, V1, https://doi.org/10.15785/SBGRID/986.

Download Citation

Dataset Description

native data

Project Members

Name Additional Roles Affiliation While Working on the Project
Hartmut H NiemannData Collector, DepositorBielefeld University, Department of Chemistry
Maren BussData CollectorBielefeld University, Department of Chemistry
Hartmut NiemannPIBielefeld University

Reprocessing Instructions

XDS.INP file used for processing is given as template.

Processing Bundle

Reprocessing Data

About Reprocessing

Version:

version unreported

Project:

AUTOMATIC

Crystal:

DEFAULT

Sequence Length:

0

Wavelength:

SAD - 0.91714

Sweep:

SWEEP1

Files:

/programs/datagrid/986/cwi016_2_1_####.cbf

Images:

1 - 3600

Beam:

(147.4, 133.82) -> (147.4, 133.6)

Distance:

167.86 -> 166.02

Spacegroup:

P 31

For AUTOMATIC/DEFAULT/SAD:

ALL LOW HIGH
High resolution limit 1.51 4.1 1.51
Low resolution limit 45.64 45.67 1.54
Completeness 100.0 100.0 100.0
Multiplicity 10.3 10.7 9.6
I/sigma 13.3 59.4 1.0
Rmerge 0.097 0.029 2.181
CC half 0.999 1.0 0.37
Anomalous completeness 99.9 100.0 99.3
Anomalous multiplicity 5.1 5.1 5.1
Cell 119.92 119.92 70.39 90.0 90.0 120.0

Version:

version unreported

Project:

AUTOMATIC

Crystal:

DEFAULT

Sequence Length:

0

Wavelength:

SAD - 0.91714

Sweep:

SWEEP1

Files:

/programs/datagrid/986/cwi016_2_1_####.cbf

Images:

1 - 3600

Beam:

(147.4, 133.82) -> (147.4, 133.6)

Distance:

167.86 -> 166.51

Spacegroup:

P 31

For AUTOMATIC/DEFAULT/SAD:

ALL LOW HIGH
High resolution limit 1.51 4.1 1.51
Low resolution limit 59.97 60.01 1.54
Completeness 100.0 100.0 100.0
Multiplicity 10.3 10.7 9.6
I/sigma 13.3 59.6 1.0
Rmerge 0.097 0.029 2.188
CC half 0.999 1.0 0.362
Anomalous completeness 99.9 100.0 99.9
Anomalous multiplicity 5.1 5.1 5.1
Cell 119.93 119.93 70.4 90.0 90.0 120.0

Version:

version unreported

Project:

AUTOMATIC

Crystal:

DEFAULT

Sequence Length:

0

Wavelength:

SAD - 0.91714

Sweep:

SWEEP1

Files:

/programs/datagrid/986/cwi016_2_1_####.cbf

Images:

1 - 3600

Beam:

(147.4, 133.82) -> (147.4, 133.61)

Distance:

167.86 -> 166.31

Spacegroup:

P 31

For AUTOMATIC/DEFAULT/SAD:

ALL LOW HIGH
High resolution limit 1.41 3.83 1.41
Low resolution limit 103.85 104.13 1.43
Completeness 100.0 100.0 99.8
Multiplicity 10.3 10.7 10.0
I/sigma 3.6 25.8 0.1
Rmerge 0.159 0.094 2.935
CC half 0.995 0.992 0.318
Anomalous completeness 100.0 100.0 99.8
Anomalous multiplicity 5.1 5.1 5.1
Cell 119.911 119.911 70.373 90.0 90.0 120.0

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.