PDB-6jw4: Degenerate RVD RG forms a distinct loop conformation

ID or keywords:

Entry

Database: PDB / ID: 6jw4

Title

Degenerate RVD RG forms a distinct loop conformation

Components

DNA (5'-D(*AP*GP*AP*GP*AP*CP*GP*CP*GP*AP*AP*GP*GP*GP*AP*CP*A)-3')
DNA (5'-D(*TP*GP*TP*CP*CP*CP*TP*TP*(5HC)P*GP*CP*GP*TP*CP*TP*CP*T)-3')
TAL effector

Keywords

DNA BINDING PROTEIN/DNA / methylation TAL effector complex / DNA BINDING PROTEIN-DNA complex

Function / homology

TAL effector repeat / TAL effector repeat / DNA / DNA (> 10) / Hax3

Function and homology information

Biological species

Xanthomonas campestris pv. armoraciae (bacteria)
synthetic construct (others)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 3.09 Å

Authors

Liu, L. / Yi, C.

Funding support

China, 2items

Citation

Journal: J.Mol.Biol. / Year: 2020
Title: Structural Insights into the Specific Recognition of 5-methylcytosine and 5-hydroxymethylcytosine by TAL Effectors.
Authors: Liu, L. / Zhang, Y. / Liu, M. / Wei, W. / Yi, C. / Peng, J.

History

Deposition	Apr 18, 2019	Deposition site: PDBJ / Processing site: PDBJ
Revision 1.0	Apr 22, 2020	Provider: repository / Type: Initial release
Revision 1.1	Nov 4, 2020	Group: Database references / Category: citation / citation_author Item: _citation.country / _citation.journal_abbrev ..._citation.country / _citation.journal_abbrev / _citation.journal_id_ASTM / _citation.journal_id_CSD / _citation.journal_id_ISSN / _citation.journal_volume / _citation.page_first / _citation.page_last / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year
Revision 1.2	Nov 22, 2023	Group: Data collection / Database references / Refinement description Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / struct_ncs_dom_lim Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_ncs_dom_lim.beg_auth_comp_id / _struct_ncs_dom_lim.beg_label_asym_id / _struct_ncs_dom_lim.beg_label_comp_id / _struct_ncs_dom_lim.beg_label_seq_id / _struct_ncs_dom_lim.end_auth_comp_id / _struct_ncs_dom_lim.end_label_asym_id / _struct_ncs_dom_lim.end_label_comp_id / _struct_ncs_dom_lim.end_label_seq_id

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	6jw4.cif.gz	865 KB	Display	PDBx/mmCIF format
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Validation report

Summary document	6jw4_validation.pdf.gz	527.6 KB	Display	wwPDB validaton report
Full document	6jw4_full_validation.pdf.gz	562.9 KB	Display
Data in XML	6jw4_validation.xml.gz	69.9 KB	Display
Data in CIF	6jw4_validation.cif.gz	95.9 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/jw/6jw4 ftp://data.pdbj.org/pub/pdb/validation_reports/jw/6jw4	HTTPS FTP

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Related structure data

Related structure data	6jvzC 6jw0C 6jw1C 6jw2C 6jw3C 6jw5C 4gjpS S: Starting model for refinement C: citing same article (ref.)
Similar structure data	6jw5-2 6jw3-1 6jw3-4 4ot3-2 4osw-2 6jtq-1 4osq-2 4ot3-1 4ot0-2 4osk-1 Search similar-shape structures by Omokage search (details) Search similar-shape structures by Omokage search (details) Search similar-shape structures by Omokage search (details) Search similar-shape structures by Omokage search (details) Search similar-shape structures by Omokage search (details) Similarity search - Function & homologyF&H Search Similarity search - HomologyF&H Search

Related structure data

S: Starting model for refinement

C: citing same article (ref.)

Similar structure data

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Links

PDB pages	PDBj / wwPDB / NCBI
Related items in Molecule of the Month	#67 - Jul 2005 TATA-Binding Protein similarity (1) #168 - Dec 2013 DNA Helicase similarity (1) #91 - Jul 2007 Thymine Dimers similarity (1) #255 - Mar 2021 Cisplatin and DNA similarity (1) #253 - Jan 2021 Expressome similarity (1) #122 - Feb 2010 Enhanceosome similarity (1) #181 - Jan 2015 Cascade and CRISPR similarity (1) #172 - Apr 2014 RecA and Rad51 similarity (1) #180 - Dec 2014 TAL Effectors similarity (3) #150 - Jun 2012 Sliding Clamps similarity (1) #135 - Mar 2011 Integrase similarity (1) #48 - Dec 2003 Catabolite Activator Protein similarity (1) #227 - Nov 2018 Telomerase similarity (1) #84 - Dec 2006 Transposase similarity (1) #112 - Apr 2009 Oct and Sox Transcription Factors similarity (1) #155 - Nov 2012 Vitamin D Receptor similarity (1) #3 - Mar 2000 DNA Polymerase similarity (1) #139 - Jul 2011 DNA Methyltransferase similarity (1) #87 - Mar 2007 Zinc Fingers similarity (1) #40 - Apr 2003 RNA Polymerase similarity (1) #73 - Jan 2006 Topoisomerase similarity (1) #55 - Jul 2004 DNA Ligase similarity (1) #8 - Aug 2000 Restriction Enzymes similarity (1) #125 - May 2010 Parvoviruses similarity (1) #7 - Jul 2000 Nucleosome similarity (1) #119 - Nov 2009 Designed DNA Crystal similarity (1) #45 - Sep 2003 Estrogen Receptor similarity (1) #31 - Jul 2002 p53 Tumor Suppressor similarity (1) #39 - Mar 2003 lac Repressor similarity (1) #33 - Sep 2002 HIV Reverse Transcriptase similarity (1) #160 - Apr 2013 Actinomycin similarity (1) #258 - Jun 2021 Glucocorticoid Receptor and Dexamethasone similarity (1) #257 - May 2021 Fetal Hemoglobin similarity (1) #131 - Nov 2010 Inteins similarity (1) #240 - Dec 2019 Hypoxia-Inducible Factors similarity (1) #23 - Nov 2001 DNA similarity (1) #190 - Oct 2015 Two-component Systems similarity (1) #92 - Aug 2007 Anabolic Steroids similarity (1) #241 - Jan 2020 Twenty Years of Molecules similarity (1)

PDB pages

PDBj /

wwPDB /

NCBI

Related items in Molecule of the Month

#67 - Jul 2005
TATA-Binding Protein
similarity (1)
#168 - Dec 2013
DNA Helicase
similarity (1)
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Thymine Dimers
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#255 - Mar 2021
Cisplatin and DNA
similarity (1)
#253 - Jan 2021
Expressome
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#122 - Feb 2010
Enhanceosome
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#181 - Jan 2015
Cascade and CRISPR
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#172 - Apr 2014
RecA and Rad51
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Sliding Clamps
similarity (1)
#135 - Mar 2011
Integrase
similarity (1)
#48 - Dec 2003
Catabolite Activator Protein
similarity (1)
#227 - Nov 2018
Telomerase
similarity (1)
#84 - Dec 2006
Transposase
similarity (1)
#112 - Apr 2009
Oct and Sox Transcription Factors
similarity (1)
#155 - Nov 2012
Vitamin D Receptor
similarity (1)
#3 - Mar 2000
DNA Polymerase
similarity (1)
#139 - Jul 2011
DNA Methyltransferase
similarity (1)
#87 - Mar 2007
Zinc Fingers
similarity (1)
#40 - Apr 2003
RNA Polymerase
similarity (1)
#73 - Jan 2006
Topoisomerase
similarity (1)
#55 - Jul 2004
DNA Ligase
similarity (1)
#8 - Aug 2000
Restriction Enzymes
similarity (1)
#125 - May 2010
Parvoviruses
similarity (1)
#7 - Jul 2000
Nucleosome
similarity (1)
#119 - Nov 2009
Designed DNA Crystal
similarity (1)
#45 - Sep 2003
Estrogen Receptor
similarity (1)
#31 - Jul 2002
p53 Tumor Suppressor
similarity (1)
#39 - Mar 2003
lac Repressor
similarity (1)
#33 - Sep 2002
HIV Reverse Transcriptase
similarity (1)
#160 - Apr 2013
Actinomycin
similarity (1)
#258 - Jun 2021
Glucocorticoid Receptor and Dexamethasone
similarity (1)
#257 - May 2021
Fetal Hemoglobin
similarity (1)
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Inteins
similarity (1)
#240 - Dec 2019
Hypoxia-Inducible Factors
similarity (1)
#23 - Nov 2001
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similarity (1)
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#241 - Jan 2020
Twenty Years of Molecules
similarity (1)

Deposited unit

A: TAL effector

I: DNA (5'-D(*TP*GP*TP*CP*CP*CP*TP*TP*(5HC)P*GP*CP*GP*TP*CP*TP*CP*T)-3')

J: DNA (5'-D(*AP*GP*AP*GP*AP*CP*GP*CP*GP*AP*AP*GP*GP*GP*AP*CP*A)-3')

B: TAL effector

C: DNA (5'-D(*TP*GP*TP*CP*CP*CP*TP*TP*(5HC)P*GP*CP*GP*TP*CP*TP*CP*T)-3')

D: DNA (5'-D(*AP*GP*AP*GP*AP*CP*GP*CP*GP*AP*AP*GP*GP*GP*AP*CP*A)-3')

E: TAL effector

F: DNA (5'-D(*TP*GP*TP*CP*CP*CP*TP*TP*(5HC)P*GP*CP*GP*TP*CP*TP*CP*T)-3')

G: DNA (5'-D(*AP*GP*AP*GP*AP*CP*GP*CP*GP*AP*AP*GP*GP*GP*AP*CP*A)-3')

H: TAL effector

K: DNA (5'-D(*TP*GP*TP*CP*CP*CP*TP*TP*(5HC)P*GP*CP*GP*TP*CP*TP*CP*T)-3')

L: DNA (5'-D(*AP*GP*AP*GP*AP*CP*GP*CP*GP*AP*AP*GP*GP*GP*AP*CP*A)-3')

249 kDa, 12 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

A: TAL effector

I: DNA (5'-D(*TP*GP*TP*CP*CP*CP*TP*TP*(5HC)P*GP*CP*GP*TP*CP*TP*CP*T)-3')

J: DNA (5'-D(*AP*GP*AP*GP*AP*CP*GP*CP*GP*AP*AP*GP*GP*GP*AP*CP*A)-3')

defined by author&software
Evidence: gel filtration
62.3 kDa, 3 polymers
Search similar-shape structures of this assembly by Omokage search (details)

2

B: TAL effector

C: DNA (5'-D(*TP*GP*TP*CP*CP*CP*TP*TP*(5HC)P*GP*CP*GP*TP*CP*TP*CP*T)-3')

D: DNA (5'-D(*AP*GP*AP*GP*AP*CP*GP*CP*GP*AP*AP*GP*GP*GP*AP*CP*A)-3')

defined by author&software
62.3 kDa, 3 polymers
Search similar-shape structures of this assembly by Omokage search (details)

3

E: TAL effector

F: DNA (5'-D(*TP*GP*TP*CP*CP*CP*TP*TP*(5HC)P*GP*CP*GP*TP*CP*TP*CP*T)-3')

G: DNA (5'-D(*AP*GP*AP*GP*AP*CP*GP*CP*GP*AP*AP*GP*GP*GP*AP*CP*A)-3')

defined by author&software
62.3 kDa, 3 polymers
Search similar-shape structures of this assembly by Omokage search (details)

4

H: TAL effector

K: DNA (5'-D(*TP*GP*TP*CP*CP*CP*TP*TP*(5HC)P*GP*CP*GP*TP*CP*TP*CP*T)-3')

L: DNA (5'-D(*AP*GP*AP*GP*AP*CP*GP*CP*GP*AP*AP*GP*GP*GP*AP*CP*A)-3')

defined by author&software
62.3 kDa, 3 polymers
Search similar-shape structures of this assembly by Omokage search (details)

Unit cell

Length a, b, c (Å)	94.050, 93.971, 167.686
Angle α, β, γ (deg.)	90.000, 102.820, 90.000
Int Tables number	4
Space group name H-M	P12₁1

Noncrystallographic symmetry (NCS)

NCS domain:
NCS domain segments:

Component-ID: _ / Refine code: _

Dom-ID	Ens-ID	Beg auth comp-ID	Beg label comp-ID	End auth comp-ID	End label comp-ID	Auth asym-ID	Label asym-ID	Auth seq-ID	Label seq-ID
1	1	MET	MET	LEU	LEU	A	A	230 - 721	1 - 492
2	1	MET	MET	LEU	LEU	B	D	230 - 721	1 - 492
1	2	MET	MET	LEU	LEU	A	A	230 - 721	1 - 492
2	2	MET	MET	LEU	LEU	E	G	230 - 721	1 - 492
1	3	MET	MET	LEU	LEU	A	A	230 - 721	1 - 492
2	3	MET	MET	LEU	LEU	H	J	230 - 721	1 - 492
1	4	DT	DT	DT	DT	I	B	-2 - 14	1 - 17
2	4	DT	DT	DT	DT	C	E	-2 - 14	1 - 17
1	5	DT	DT	DT	DT	I	B	-2 - 14	1 - 17
2	5	DT	DT	DT	DT	F	H	-2 - 14	1 - 17
1	6	DT	DT	DT	DT	I	B	-2 - 14	1 - 17
2	6	DT	DT	DT	DT	K	K	-2 - 14	1 - 17
1	7	DA	DA	DA	DA	J	C	-14 - 2	1 - 17
2	7	DA	DA	DA	DA	D	F	-14 - 2	1 - 17
1	8	DA	DA	DA	DA	J	C	-14 - 2	1 - 17
2	8	DA	DA	DA	DA	G	I	-14 - 2	1 - 17
1	9	DA	DA	DA	DA	J	C	-14 - 2	1 - 17
2	9	DA	DA	DA	DA	L	L	-14 - 2	1 - 17
1	10	MET	MET	LEU	LEU	B	D	230 - 721	1 - 492
2	10	MET	MET	LEU	LEU	E	G	230 - 721	1 - 492
1	11	MET	MET	LEU	LEU	B	D	230 - 721	1 - 492
2	11	MET	MET	LEU	LEU	H	J	230 - 721	1 - 492
1	12	DT	DT	DT	DT	C	E	-2 - 14	1 - 17
2	12	DT	DT	DT	DT	F	H	-2 - 14	1 - 17
1	13	DT	DT	DT	DT	C	E	-2 - 14	1 - 17
2	13	DT	DT	DT	DT	K	K	-2 - 14	1 - 17
1	14	DA	DA	DA	DA	D	F	-14 - 2	1 - 17
2	14	DA	DA	DA	DA	G	I	-14 - 2	1 - 17
1	15	DA	DA	DA	DA	D	F	-14 - 2	1 - 17
2	15	DA	DA	DA	DA	L	L	-14 - 2	1 - 17
1	16	MET	MET	LEU	LEU	E	G	230 - 721	1 - 492
2	16	MET	MET	LEU	LEU	H	J	230 - 721	1 - 492
1	17	DT	DT	DT	DT	F	H	-2 - 14	1 - 17
2	17	DT	DT	DT	DT	K	K	-2 - 14	1 - 17
1	18	DA	DA	DA	DA	G	I	-14 - 2	1 - 17
2	18	DA	DA	DA	DA	L	L	-14 - 2	1 - 17

NCS ensembles :

#1: Protein	TAL effector Mass: 51881.672 Da / Num. of mol.: 4 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Xanthomonas campestris pv. armoraciae (bacteria) Production host: Escherichia coli (E. coli) / References: UniProt: Q3ZD72*PLUS
#2: DNA chain	DNA (5'-D(TPGPTPCPCPCPTPTP(5HC)PGPCPGPTPCPTPCPT)-3') Mass: 5126.308 Da / Num. of mol.: 4 / Source method: obtained synthetically / Source*: (synth.) synthetic construct (others)
#3: DNA chain	DNA (5'-D(APGPAPGPAPCPGPCPGPAPAPGPGPGPAPCPA)-3') Mass: 5319.477 Da / Num. of mol.: 4 / Source method: obtained synthetically / Source*: (synth.) synthetic construct (others)
Has ligand of interest	Y

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Experiment

Experiment	Method: X-RAY DIFFRACTION / Number of used crystals: 1

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Sample preparation

Crystal	Density Matthews: 2.9 Å³/Da / Density % sol: 57.56 %
Crystal grow	Temperature: 291 K / Method: vapor diffusion, sitting drop Details: 8-10% PEG3350 (w/v), 10% ethanol and 0.1M MES pH 6.7

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Data collection

Diffraction	Mean temperature: 100 K / Serial crystal experiment: N
Diffraction source	Source: SYNCHROTRON / Site: SSRF / Beamline: BL18U1 / Wavelength: 0.9793 Å
Detector	Type: MAR CCD 130 mm / Detector: CCD / Date: Jul 18, 2017
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.9793 Å / Relative weight: 1
Reflection	Resolution: 3.09→163.51 Å / Num. obs: 43409 / % possible obs: 99.5 % / Redundancy: 4.2 % / R_rim(I) all: 0.107 / Net I/σ(I): 2.05
Reflection shell	Resolution: 3.09→3.21 Å / Num. unique obs: 43409 / R_rim(I) all: 0.107

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Processing

Software

Name	Version	Classification
REFMAC	5.8.0049	refinement
HKL-3000		data reduction
SCALEPACK		data scaling
PHASER		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: 4GJP

4gjp

Resolution: 3.09→163.51 Å / Cor.coef. F_o:F_c: 0.892 / Cor.coef. F_o:F_c free: 0.868 / SU B: 42 / SU ML: 0.454 / Cross valid method: THROUGHOUT / σ(F): 0 / ESU R Free: 0.567
Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS U VALUES: WITH TLS ADDED SF FILE CONTAINS FRIEDEL PAIRS UNDER I/F_MINUS AND I/F_PLUS COLUMNS.

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.2747	2320	5.1 %	RANDOM
R_work	0.2434	-	-	-
obs	0.2449	43409	86.93 %	-

Solvent computation

Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å

Displacement parameters

B_iso max: 227.11 Å² / B_iso mean: 70 Å² / B_iso min: 27.22 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	1.26 Å²	0 Å²	3.86 Å²
2-	-	-2.36 Å²	0 Å²
3-	-	-	-0.6 Å²

Refinement step

Cycle: final / Resolution: 3.09→163.51 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	14268	2768	0	0	17036
Num. residues	-	-	-	-	2104

Refine LS restraints

Refine-ID	Type	Dev ideal	Dev ideal target	Number
X-RAY DIFFRACTION	r_bond_refined_d	0.009	0.018	17572
X-RAY DIFFRACTION	r_bond_other_d	0.004	0.02	16272
X-RAY DIFFRACTION	r_angle_refined_deg	1.392	1.831	24532
X-RAY DIFFRACTION	r_angle_other_deg	1.115	3	37392
X-RAY DIFFRACTION	r_dihedral_angle_1_deg	6.224	5	1964
X-RAY DIFFRACTION	r_dihedral_angle_2_deg	40.606	25.821	536
X-RAY DIFFRACTION	r_dihedral_angle_3_deg	18.438	15	2368
X-RAY DIFFRACTION	r_dihedral_angle_4_deg	19.371	15	72
X-RAY DIFFRACTION	r_chiral_restr	0.072	0.2	2860
X-RAY DIFFRACTION	r_gen_planes_refined	0.007	0.021	18432
X-RAY DIFFRACTION	r_gen_planes_other	0.004	0.02	3680

Refine LS restraints NCS

Refine-ID: X-RAY DIFFRACTION / Type: interatomic distance / Weight position: 0.05

Ens-ID	Dom-ID	Auth asym-ID	Number	Rms dev position (Å)
1	1	A	30828	0.05
1	2	B	30828	0.05
2	1	A	30791	0.04
2	2	E	30791	0.04
3	1	A	30661	0.05
3	2	H	30661	0.05
4	1	I	1413	0.07
4	2	C	1413	0.07
5	1	I	1399	0.06
5	2	F	1399	0.06
6	1	I	1354	0.12
6	2	K	1354	0.12
7	1	J	1298	0.02
7	2	D	1298	0.02
8	1	J	1282	0.04
8	2	G	1282	0.04
9	1	J	1298	0.03
9	2	L	1298	0.03
10	1	B	30702	0.05
10	2	E	30702	0.05
11	1	B	30580	0.06
11	2	H	30580	0.06
12	1	C	1404	0.07
12	2	F	1404	0.07
13	1	C	1349	0.12
13	2	K	1349	0.12
14	1	D	1278	0.05
14	2	G	1278	0.05
15	1	D	1292	0.03
15	2	L	1292	0.03
16	1	E	30652	0.06
16	2	H	30652	0.06
17	1	F	1353	0.11
17	2	K	1353	0.11
18	1	G	1277	0.05
18	2	L	1277	0.05

LS refinement shell

Resolution: 3.09→3.169 Å / R_factor R_free error: 0

	R_factor	Num. reflection	% reflection
R_free	0.448	68	-
R_work	0.368	1330	-
obs	-	-	36.26 %

Refinement TLS params.

Method: refined / Refine-ID: X-RAY DIFFRACTION

ID	L11 (°²)	L12 (°²)	L13 (°²)	L22 (°²)	L23 (°²)	L33 (°²)	S11 (Å °)	S12 (Å °)	S13 (Å °)	S21 (Å °)	S22 (Å °)	S23 (Å °)	S31 (Å °)	S32 (Å °)	S33 (Å °)	T11 (Å²)	T12 (Å²)	T13 (Å²)	T22 (Å²)	T23 (Å²)	T33 (Å²)	Origin x (Å)	Origin y (Å)	Origin z (Å)
1	2.0009	0.4824	0.3222	3.648	0.6454	4.0149	-0.219	0.0935	0.0835	-0.2349	0.2722	0.0006	-0.0863	-0.1744	-0.0532	0.1417	-0.0161	-0.1558	0.3878	0.0413	0.2119	-1.014	0.3649	22.8157
2	2.7951	-0.9773	-1.4454	3.6702	-2.5983	3.7123	-0.0087	-0.3857	0.1171	-0.309	0.0657	0.0078	0.2315	0.4796	-0.057	0.2364	-0.18	-0.1052	0.5307	-0.0933	0.1585	0.9162	-3.5405	17.6093
3	3.894	0.1484	2.1486	3.399	1.6868	6.5302	0.2682	0.0761	0.1016	-0.6496	0.0898	-0.6178	-0.6357	-0.0984	-0.3579	0.451	-0.1626	-0.01	0.3664	-0.02	0.2579	2.7528	-2.7874	16.3981
4	1.5695	0.6763	-0.5557	3.1536	-1.2565	2.609	0.0374	-0.1001	-0.0984	0.5879	-0.1277	-0.1358	-0.4333	0.467	0.0904	0.373	-0.0569	-0.2256	0.3866	-0.0054	0.2447	-20.9289	47.0758	60.6992
5	4.1985	1.7394	-2.6553	4.2672	1.138	3.1149	0.3888	0.0556	-0.1588	0.5143	-0.3721	-0.2376	-0.1589	-0.2506	-0.0167	0.539	-0.1045	-0.1702	0.2212	0.1152	0.1479	-23.0595	43.1468	65.6305
6	3.8681	-0.4035	0.2064	3.9792	-1.2471	5.2344	0.0514	-0.147	0.1023	0.8459	0.0167	0.4142	-1.1469	0.0715	-0.0681	0.6456	0.0132	-0.0659	0.2329	0.0583	0.2711	-25.1863	43.8494	66.6826
7	3.3871	-1.7245	-1.5317	2.5722	0.8501	2.9476	0.3771	0.4081	-0.1872	-0.6427	-0.6526	-0.1445	-0.0035	0.0099	0.2755	0.5668	0.1345	-0.1671	0.5364	-0.0537	0.43	29.9651	-7.4016	60.9532
8	1.4969	-2.8839	-1.5377	8.001	-0.2515	5.8573	0.3811	-0.0402	-0.1122	-0.9778	-0.4042	0.2129	-0.1026	0.608	0.0231	0.4866	0.199	-0.0779	0.5164	-0.1911	0.3919	35.7377	-10.2299	58.3306
9	7.5519	-1.0489	-1.5242	4.8089	1.2704	5.2957	-0.4729	0.3738	-0.4657	-0.6232	0.1244	-0.2723	-0.0024	0.0575	0.3485	0.687	0.2048	-0.0405	0.3771	0.144	0.4369	35.4151	-12.5595	57.795
10	3.2924	0.7166	0.2688	1.9239	-0.326	3.6012	0.0629	0.1214	-0.0024	0.0112	-0.2558	0.0711	0.4325	0.0153	0.1929	0.3557	0.0794	-0.1621	0.4243	-0.0359	0.3157	46.254	40.2013	19.2269
11	0.4954	0.3522	-1.6896	6.3731	-0.6027	6.0676	-0.0852	0.1388	-0.0552	-0.2404	-0.059	0.5084	0.6354	-0.4846	0.1441	0.3139	-0.0904	-0.1414	0.4119	-0.0349	0.2021	40.1084	37.1551	21.1022
12	9.4354	-0.1938	2.2635	4.0013	-0.1017	2.9391	-0.4399	-0.2996	-0.4119	0.3844	0.176	0.2108	0.5094	-0.1666	0.2638	0.4552	-0.1086	-0.0787	0.5178	-0.0535	0.3799	40.3482	35.0274	21.5987

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Auth asym-ID	Auth seq-ID
1	X-RAY DIFFRACTION	1	A	230 - 721
2	X-RAY DIFFRACTION	2	I	-2 - 14
3	X-RAY DIFFRACTION	3	J	-14 - 2
4	X-RAY DIFFRACTION	4	B	230 - 721
5	X-RAY DIFFRACTION	5	C	-2 - 14
6	X-RAY DIFFRACTION	6	D	-14 - 2
7	X-RAY DIFFRACTION	7	E	230 - 721
8	X-RAY DIFFRACTION	8	F	-2 - 14
9	X-RAY DIFFRACTION	9	G	-14 - 2
10	X-RAY DIFFRACTION	10	H	230 - 721
11	X-RAY DIFFRACTION	11	K	-2 - 14
12	X-RAY DIFFRACTION	12	L	-14 - 2

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