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- PDB-8qtf: Crystal structure of a C-terminally truncated version of Arabidop... -

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Open data

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Basic information

Entry

Database: PDB / ID: 8qtf

Title

Crystal structure of a C-terminally truncated version of Arabidopsis thaliana 14-3-3 omega in complex with a phosphopeptide from the transcription factor BZR1.

Components

14-3-3-like protein GF14 omega
Protein BRASSINAZOLE-RESISTANT 1

Keywords

PROTEIN BINDING / 14-3-3 / brassinosteroid signaling / phosphopeptide / transcription factor / signal transduction

Function / homology

Function and homology information

brassinosteroid mediated signaling pathway / plant-type vacuole / Golgi apparatus / mitochondrion / nucleus / cytosol
Similarity search - Function

Biological species

Arabidopsis thaliana (thale cress)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 1.9 Å

Authors

Hothorn, M. / Obergfell, E.

Funding support

Switzerland, 1items

Citation

Journal: Plant Cell.Physiol. / Year: 2024
Title: Mechanistic Insights into the Function of 14-3-3 Proteins as Negative Regulators of Brassinosteroid Signaling in Arabidopsis.
Authors: Obergfell, E. / Hohmann, U. / Moretti, A. / Chen, H. / Hothorn, M.

History

Deposition	Oct 12, 2023	Deposition site: PDBE / Processing site: PDBE
Revision 1.0	Nov 22, 2023	Provider: repository / Type: Initial release
Revision 1.1	Jun 5, 2024	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.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year
Revision 1.2	Oct 9, 2024	Group: Structure summary / Category: pdbx_entry_details / pdbx_modification_feature / Item: _pdbx_entry_details.has_protein_modification
Revision 1.3	Nov 20, 2024	Group: Database references / Category: citation Item: _citation.journal_volume / _citation.page_first ..._citation.journal_volume / _citation.page_first / _citation.page_last / _citation.title

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Structure visualization

Structure viewer	Molecule: MolmilJmol/JSmol

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Downloads & links

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Download

PDBx/mmCIF format	8qtf.cif.gz	1.6 MB	Display	PDBx/mmCIF format
PDB format	pdb8qtf.ent.gz	1.2 MB	Display	PDB format
PDBx/mmJSON format	8qtf.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Summary document	8qtf_validation.pdf.gz	623.9 KB	Display	wwPDB validaton report
Full document	8qtf_full_validation.pdf.gz	642.2 KB	Display
Data in XML	8qtf_validation.xml.gz	88.6 KB	Display
Data in CIF	8qtf_validation.cif.gz	122.7 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/qt/8qtf ftp://data.pdbj.org/pub/pdb/validation_reports/qt/8qtf	HTTPS FTP

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Related structure data

Related structure data	8qt5C 8qtcC 8qttC C: citing same article (ref.)
Similar structure data	Similarity search - Function & homologyF&H Search Similarity search - FunctionF&H Search Similarity search - HomologyF&H Search

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Links

PDB pages	PDBj / wwPDB / NCBI
Related items in Molecule of the Month	#222 - Jun 2018 Proteins and Nanoparticles similarity (8)

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Assembly

Deposited unit

A: 14-3-3-like protein GF14 omega

B: 14-3-3-like protein GF14 omega

C: 14-3-3-like protein GF14 omega

D: 14-3-3-like protein GF14 omega

E: 14-3-3-like protein GF14 omega

F: 14-3-3-like protein GF14 omega

G: 14-3-3-like protein GF14 omega

H: 14-3-3-like protein GF14 omega

I: 14-3-3-like protein GF14 omega

J: 14-3-3-like protein GF14 omega

K: Protein BRASSINAZOLE-RESISTANT 1

L: Protein BRASSINAZOLE-RESISTANT 1

M: Protein BRASSINAZOLE-RESISTANT 1

N: Protein BRASSINAZOLE-RESISTANT 1

O: Protein BRASSINAZOLE-RESISTANT 1

P: Protein BRASSINAZOLE-RESISTANT 1

Q: Protein BRASSINAZOLE-RESISTANT 1

R: Protein BRASSINAZOLE-RESISTANT 1

S: Protein BRASSINAZOLE-RESISTANT 1

T: Protein BRASSINAZOLE-RESISTANT 1

hetero molecules

282 kDa, 20 polymers
Search similar-shape structures of this assembly by Omokage search (details)

A: 14-3-3-like protein GF14 omega

B: 14-3-3-like protein GF14 omega

K: Protein BRASSINAZOLE-RESISTANT 1

L: Protein BRASSINAZOLE-RESISTANT 1

hetero molecules

defined by author&software
Evidence: light scattering
56.5 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

C: 14-3-3-like protein GF14 omega

D: 14-3-3-like protein GF14 omega

M: Protein BRASSINAZOLE-RESISTANT 1

N: Protein BRASSINAZOLE-RESISTANT 1

hetero molecules

defined by author&software
56.3 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

E: 14-3-3-like protein GF14 omega

F: 14-3-3-like protein GF14 omega

O: Protein BRASSINAZOLE-RESISTANT 1

P: Protein BRASSINAZOLE-RESISTANT 1

hetero molecules

defined by author&software
56.5 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

G: 14-3-3-like protein GF14 omega

H: 14-3-3-like protein GF14 omega

Q: Protein BRASSINAZOLE-RESISTANT 1

R: Protein BRASSINAZOLE-RESISTANT 1

hetero molecules

defined by author&software
56.6 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

I: 14-3-3-like protein GF14 omega

J: 14-3-3-like protein GF14 omega

S: Protein BRASSINAZOLE-RESISTANT 1

T: Protein BRASSINAZOLE-RESISTANT 1

hetero molecules

defined by author&software
56.4 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

Unit cell

Length a, b, c (Å)	71.641, 71.917, 151.662
Angle α, β, γ (deg.)	100.250, 94.840, 89.230
Int Tables number	1
Space group name H-M	P1
Space group name Hall	P1
Symmetry operation	#1: x,y,z

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Components

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Protein / Protein/peptide , 2 types, 20 molecules ABCDEFGHIJKLMNOPQRST

#1: Protein	14-3-3-like protein GF14 omega Mass: 27299.682 Da / Num. of mol.: 10 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Arabidopsis thaliana (thale cress) / Strain: Col0 / Gene: GRF2 / Plasmid: pMH-HStrxT / Production host: Escherichia coli BL21 (bacteria) / Variant (production host): DE3 RIL / References: UniProt: Q01525
#2: Protein/peptide	Protein BRASSINAZOLE-RESISTANT 1 Mass: 824.797 Da / Num. of mol.: 10 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Arabidopsis thaliana (thale cress) / Strain: Col0 / Gene: BZR1 / Plasmid: pMH-HStrxT / Production host: Escherichia coli BL21 (bacteria) / Variant (production host): DE3 RIL

#1: Protein

14-3-3-like protein GF14 omega

Mass: 27299.682 Da / Num. of mol.: 10
Source method: isolated from a genetically manipulated source
Source: (gene. exp.)

Arabidopsis thaliana (thale cress) / Strain: Col0 / Gene: GRF2 / Plasmid: pMH-HStrxT / Production host:

Escherichia coli BL21 (bacteria) / Variant (production host): DE3 RIL / References: UniProt: Q01525

#2: Protein/peptide

Protein BRASSINAZOLE-RESISTANT 1

Mass: 824.797 Da / Num. of mol.: 10
Source method: isolated from a genetically manipulated source
Source: (gene. exp.)

Arabidopsis thaliana (thale cress) / Strain: Col0 / Gene: BZR1 / Plasmid: pMH-HStrxT / Production host:

Escherichia coli BL21 (bacteria) / Variant (production host): DE3 RIL

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Non-polymers , 7 types, 902 molecules

#3: Chemical	ChemComp-FMT / FORMIC ACID Mass: 46.025 Da / Num. of mol.: 9 / Source method: obtained synthetically / Formula: CH₂O₂
#4: Chemical	ChemComp-EDO / 1,2-ETHANEDIOL / ETHYLENE GLYCOL Mass: 62.068 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: C₂H₆O₂
#5: Chemical	ChemComp-NA / SODIUM ION Mass: 22.990 Da / Num. of mol.: 10 / Source method: obtained synthetically / Formula: Na
#6: Chemical	ChemComp-MPD / (4S)-2-METHYL-2,4-PENTANEDIOL Mass: 118.174 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: C₆H₁₄O₂ / Comment: precipitant*YM
#7: Chemical	ChemComp-CL / CHLORIDE ION Mass: 35.453 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: Cl
#8: Chemical	ChemComp-ACT / ACETATE ION Mass: 59.044 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: C₂H₃O₂
#9: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 876 / Source method: isolated from a natural source / Formula: H₂O

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Details

Has ligand of interest	N
Has protein modification	Y

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Experimental details

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Experiment

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

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Sample preparation

Crystal	Density Matthews: 2.56 Å³/Da / Density % sol: 51.9 %
Crystal grow	Temperature: 298 K / Method: vapor diffusion, hanging drop / pH: 7.5 Details: Morpheus (Molecular Dimensions) condition G8 with a final precipitant stock concentration of 50% v/v 12.5% w/v PEG 1000, 12.5% w/v PEG 3350, 12.5% v/v MPD ,0.02M of each carboxylic acid, 0.1M MOPS/HEPES-Na pH7.5

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Data collection

Diffraction	Mean temperature: 100 K / Serial crystal experiment: N
Diffraction source	Source: SYNCHROTRON / Site: SLS / Beamline: X06DA / Wavelength: 0.999995 Å
Detector	Type: DECTRIS PILATUS 2M-F / Detector: PIXEL / Date: Jun 10, 2018
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.999995 Å / Relative weight: 1
Reflection	Resolution: 1.9→59.91 Å / Num. obs: 227664 / % possible obs: 97.5 % / Observed criterion σ(I): -3 / Redundancy: 3.2 % / B_iso Wilson estimate: 37.07 Å² / CC_1/2: 1 / R_rim(I) all: 0.095 / Net I/σ(I): 9.47
Reflection shell	Resolution: 1.9→2.02 Å / Redundancy: 3.4 % / Mean I/σ(I) obs: 0.75 / Num. unique obs: 36285 / CC_1/2: 0.49 / R_rim(I) all: 2.11 / % possible all: 96.2

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Processing

Software

Name	Version	Classification
PHENIX	1.20.1_4487	refinement
XDS		data reduction
XSCALE		data scaling
PHASER		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT / Resolution: 1.9→59.91 Å / SU ML: 0.3106 / Cross valid method: FREE R-VALUE / σ(F): 1.96 / Phase error: 30.1693
Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2

	R_factor	Num. reflection	% reflection
R_free	0.2303	11342	5 %
R_work	0.195	215319	-
obs	0.1968	226661	97.08 %

Solvent computation

Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL

Displacement parameters

B_iso mean: 55.81 Å²

Refinement step

Cycle: LAST / Resolution: 1.9→59.91 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	19146	0	66	876	20088

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.0057	19572
X-RAY DIFFRACTION	f_angle_d	0.6425	26392
X-RAY DIFFRACTION	f_chiral_restr	0.0365	2914
X-RAY DIFFRACTION	f_plane_restr	0.0059	3438
X-RAY DIFFRACTION	f_dihedral_angle_d	12.7027	7376

LS refinement shell

Resolution (Å)	R_factor R_free	Num. reflection R_free	R_factor R_work	Num. reflection R_work	Refine-ID	% reflection obs (%)
1.9-1.92	0.4609	359	0.4497	6706	X-RAY DIFFRACTION	90.69
1.92-1.95	0.4512	367	0.4225	6974	X-RAY DIFFRACTION	94.38
1.95-1.97	0.3901	371	0.3967	7069	X-RAY DIFFRACTION	95.49
1.97-1.99	0.3776	373	0.3789	7127	X-RAY DIFFRACTION	96.03
1.99-2.02	0.3915	372	0.367	7038	X-RAY DIFFRACTION	96.02
2.02-2.05	0.3819	379	0.3473	7201	X-RAY DIFFRACTION	96.5
2.05-2.08	0.3306	371	0.3247	7038	X-RAY DIFFRACTION	96.63
2.08-2.11	0.3303	380	0.3051	7240	X-RAY DIFFRACTION	96.52
2.11-2.14	0.318	372	0.2957	7057	X-RAY DIFFRACTION	96.81
2.14-2.18	0.3085	380	0.2903	7224	X-RAY DIFFRACTION	96.5
2.18-2.21	0.3089	371	0.2711	7071	X-RAY DIFFRACTION	96.78
2.21-2.25	0.2868	380	0.2517	7189	X-RAY DIFFRACTION	97.01
2.25-2.3	0.2745	379	0.2371	7169	X-RAY DIFFRACTION	96.88
2.3-2.34	0.2619	378	0.2254	7178	X-RAY DIFFRACTION	96.87
2.34-2.4	0.2756	381	0.222	7211	X-RAY DIFFRACTION	97.16
2.4-2.45	0.2491	378	0.2158	7175	X-RAY DIFFRACTION	97.53
2.45-2.51	0.2616	379	0.2073	7199	X-RAY DIFFRACTION	97.74
2.51-2.58	0.2354	382	0.1996	7255	X-RAY DIFFRACTION	97.67
2.58-2.66	0.263	385	0.2066	7292	X-RAY DIFFRACTION	97.91
2.66-2.74	0.246	378	0.2076	7193	X-RAY DIFFRACTION	97.84
2.74-2.84	0.2583	382	0.2138	7239	X-RAY DIFFRACTION	97.97
2.84-2.95	0.233	381	0.1957	7235	X-RAY DIFFRACTION	98.25
2.95-3.09	0.2341	384	0.1901	7284	X-RAY DIFFRACTION	98.22
3.09-3.25	0.2363	384	0.1932	7299	X-RAY DIFFRACTION	98.27
3.25-3.45	0.2245	382	0.1864	7251	X-RAY DIFFRACTION	98.58
3.45-3.72	0.2106	384	0.1655	7288	X-RAY DIFFRACTION	98.7
3.72-4.1	0.1805	383	0.1447	7293	X-RAY DIFFRACTION	98.59
4.1-4.69	0.1627	384	0.1349	7281	X-RAY DIFFRACTION	98.5
4.69-5.91	0.1933	383	0.1609	7288	X-RAY DIFFRACTION	98.21
5.91-59.91	0.182	380	0.1544	7255	X-RAY DIFFRACTION	98.28

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	1.26077065213	0.350185286236	0.05890439022	2.04817052769	-0.384214412392	0.983365677458	-0.100679667322	-0.0610623166031	0.160241751365	0.120348029107	0.109722431075	0.331312081359	0.18678464174	-0.0633842085072	0.0406230227822	0.309140044356	0.0609610284731	0.0443741540869	0.349659930072	0.0416211121062	0.338786052921	41.913048623	50.1299822428	18.7745616727
2	2.18722241044	-1.60063124292	-0.108519953511	3.13081815429	-0.159997566887	2.73218442037	0.0339061681224	-0.720844261262	-0.282711467132	-0.0540122165392	-0.00656720361256	-0.207517790656	0.18720566437	0.572756040732	0.174032629145	0.418629490826	0.101027246069	0.0453345095057	0.277821213488	0.0426872096378	0.299355452832	54.257628589	38.309444592	23.1966441368
3	1.90350528129	-0.559782437572	-0.858458594376	2.3577172835	-0.078784495121	2.08247814177	0.190075998692	0.248699210313	-0.0500261001771	0.0446088617052	-0.0937381701521	0.428624053036	0.0931561182884	-0.534953968222	0.0806531431416	0.421126665596	0.0477836644369	0.0788988183289	0.437936205258	0.00755505752725	0.421695243354	30.2278346744	34.1151264236	19.0841967699
4	2.55466302964	-0.702980466618	0.664691268599	4.5704549323	-0.232100209525	0.977829752292	0.237154372144	0.0386607064105	0.194901507093	-0.788659108131	-0.029931483502	0.229595552174	-0.372543133437	-0.470379963221	-0.0448160132659	0.573235025375	0.142458600628	-0.00630673512956	0.667537393454	0.0453980226044	0.388780294946	29.8622174166	33.9491984849	4.27428825602
5	5.90756262722	1.63071507997	-0.520858850166	3.19287322012	-0.919470729543	3.79537206687	-0.0665382637051	-0.167293461401	-0.182386439431	0.135368132249	-0.0421408948979	-0.458255205893	0.0704396901946	0.632097353123	0.166734633286	0.353178158849	0.185799174769	0.050833112225	0.436463761185	0.0650082058799	0.368955003626	69.6301941654	46.3620093356	14.5551027025
6	0.955874193417	0.89866925423	-0.135074408295	1.52295196354	-0.450485569744	1.8092440264	-0.0897703125083	-0.00127032380371	0.389270682037	-0.205230053987	0.0937047348668	-0.0600477902345	0.102667997996	0.0785074771455	0.191003759972	0.28353398949	0.00573673753312	-0.0241071018413	0.382673218307	0.0623673915805	0.314704694785	55.2111396067	60.1377562231	6.85869625928
7	1.89323160591	0.944736488723	-0.303343808058	1.81508653219	-0.609737657421	1.58140549503	-0.0506145157046	-0.185283133575	0.285596784382	-0.0107483132124	0.0986954269021	0.0625889163477	-0.106687598332	0.303067306084	0.174551145703	0.242326149301	0.0161007763172	-0.0624935949364	0.407683652864	0.0303025299462	0.316117610493	62.3153137548	64.879929904	9.33904798003
8	3.18797941798	1.17722821589	0.222018495363	1.44599519848	-0.608692092561	2.4844329462	-0.176967452365	0.442782110556	-0.016068432632	-0.443447420562	0.195780169929	-0.0117954059462	-0.0160810121605	-0.0576807654133	-0.0274170416058	0.353793158221	-0.0773595074953	-0.00963183781259	0.47259183914	0.0335377547715	0.307569623849	68.4891381464	64.7722757138	-8.34282952832
9	2.57763906975	0.231624518041	-0.116764848938	1.63421473523	-0.446603977329	0.999880625551	0.0352537171856	0.665369689314	-1.0460567787	-0.707191193755	0.101072403031	0.384925166622	0.784919900381	-0.15973031144	-0.298266122177	0.62309563294	-0.175221323611	-0.0301571133136	0.632861557576	-0.0854112540025	0.478740816378	59.9684693763	57.1997951241	-13.980500902
10	2.01895195488	1.1077881957	-0.633055926453	4.41124249326	-0.434929522014	1.77291987918	-0.0524754634935	0.123662282188	-0.551367276066	-0.0056857383517	0.0553730343192	-0.439165217063	0.209344531984	0.358409186473	0.239157239857	0.282631279453	-0.000846693205152	-0.0325415955251	0.39255529686	-0.057137828174	0.409150497552	30.6403433114	10.9621286758	-4.36575827393
11	1.84945528063	0.826521103532	-0.693075926385	2.01516141877	-0.48960902576	1.07011225891	-0.158063230129	0.506813199926	0.147216603513	-0.25627387256	0.320733391217	0.301937858701	-0.150787609724	-0.276164629547	-0.172292014321	0.31198945676	-0.0410571573111	-0.0477121340672	0.429555176539	0.0294884380638	0.312989430236	11.7576281404	17.9167208979	-14.7520604507
12	2.70515668696	-1.00083784355	1.42535303697	3.19921072777	-1.45158185171	2.51141049943	-0.102427034423	0.0715972425332	-0.0492944310836	-0.169311119432	0.247177392216	-0.0320384677743	0.228897238836	-0.462874143373	-0.3512276373	0.247457667965	-0.00553255036692	-0.0412224396949	0.327316685874	-0.0102477185221	0.35999525023	12.4768830704	6.98682888205	-1.9780889512
13	1.81206534888	0.983512254775	-0.0933219740571	3.03764442049	-0.384762810082	1.02519664009	0.0894428440457	-0.0444993872631	0.20580890774	0.309284934614	0.19511627624	0.328297736991	-0.404985804041	-0.80911239176	-0.0554102315617	0.340501535241	0.0931789197594	0.0448249146625	0.408492639357	0.0173486488837	0.356368194667	3.07593162092	11.9557251114	5.52429145572
14	2.24990144252	0.329242164928	-1.00163350794	2.16712340802	-1.2723627633	1.07224032873	0.692087346654	-0.12941114999	0.942507241159	1.03902651839	-0.424743971264	-0.325822648252	-0.808294814065	0.156961780368	-0.0531933888264	0.981580812206	0.105745678725	0.0879981109486	0.400238453792	-0.0712373979352	0.599616626512	8.31381442802	23.5956994428	11.3003097363
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50	3.67967895732	5.27630457226	2.89961718883	8.17551294284	6.15927464874	8.84073535229	0.451088023127	-0.716659646036	-0.635495810319	0.305642490009	0.151952359285	-0.289884263407	0.241236099369	0.143001425899	-0.261920554439	0.556874003273	-0.166951173707	0.057316899205	0.776583289579	0.215663848974	0.582859726315	32.6195242564	42.6027308915	-12.486834579
51	0.893484572184	-0.0872748668063	-0.84264044028	0.161455309151	0.163119416962	1.14696683446	-0.0111169028467	0.200196067762	0.519855668524	-0.218760719029	-0.0667517629343	1.19737164526	-0.151055697565	-0.669064777865	0.180376225913	0.566124062374	-0.046430224025	0.0163404574786	0.469773253835	-0.0445703334852	0.592575470385	24.4315219052	23.6503184988	52.072085893
52	0.79318645124	-0.173573064035	0.771866369116	0.471348059989	0.0760332135523	0.888996308334	0.593451992489	0.230667022267	0.410902668317	-0.54840151938	0.48263715596	0.317727497752	-0.000472631945475	0.0364086988654	0.129411946854	0.63113259579	-0.123427907348	0.135547871192	0.504329451854	0.0794724057688	0.47742648047	3.79249401237	-0.411007166475	64.079671656
53	0.0222355475677	0.0157591220009	0.0166652005447	0.03696675666	0.00364608208491	0.0177744055187	0.346359327261	-0.514110266823	-0.0884664327661	0.50758103957	-0.344511153508	0.140430739419	0.0703432799409	0.637962534037	-6.53304780483E-5	0.392813747633	-0.0474774024834	-0.0246252353221	0.452657882976	-0.0476559100905	0.433441434965	11.0447158555	-6.75028060712	42.7532188534
54	0.541210856239	-0.309372418626	-0.496217626107	1.71333845353	-1.0616175639	1.60000362248	-0.0870854424178	-0.286895418446	0.197380393341	-0.115539163258	-0.786105419439	-0.194207252069	-0.552677395255	-0.0806100144298	-0.307313238584	0.398043065633	-0.101707060832	-0.0814887095234	0.322412422869	-0.0759341796677	0.415949136644	-13.8846379474	-25.2660030192	55.9391696367
55	0.0834916476018	-0.0389616550905	0.0639102859477	0.0190200803033	-0.00260381690973	0.0686512251706	-0.300697058393	-0.579826191402	-0.50880494574	-0.0742010872239	-0.098508005484	-0.26261893185	0.268545897702	0.22733549541	-0.00223958482937	0.663706972945	-0.18000050312	0.17130552304	0.472046682916	0.0163940314405	0.557943770241	10.418418751	-5.82622431096	-59.0730263379
56	0.985181704761	0.0790023460887	0.556057338584	0.183449838511	0.188545208617	0.433082778255	-0.376442545072	0.136787497582	-0.101672263022	-0.34399468204	0.0619169271795	-0.356348941699	0.145015192836	0.181304940555	-0.0636011052237	0.496494721278	-0.293232592124	-0.0642690111211	0.690262051601	0.121349578784	0.568667742234	-7.6980008515	-23.7588779823	-38.1350487095

Refinement TLS group

Refine-ID: X-RAY DIFFRACTION

ID	Refine TLS-ID	Selection details	Auth asym-ID	Label asym-ID	Auth seq-ID	Label seq-ID
1	1	chain 'A' and (resid 4 through 75 )	A	A	4 - 75	1 - 72
2	2	chain 'A' and (resid 76 through 109 )	A	A	76 - 109	73 - 106
3	3	chain 'A' and (resid 110 through 237 )	A	A	110 - 237	107 - 241
4	4	chain 'B' and (resid -1 through 41 )	B	G	-1 - 41	1 - 43
5	5	chain 'B' and (resid 42 through 76 )	B	G	42 - 76	44 - 78
6	6	chain 'B' and (resid 77 through 109 )	B	G	77 - 109	79 - 111
7	7	chain 'B' and (resid 110 through 140 )	B	G	110 - 140	112 - 142
8	8	chain 'B' and (resid 141 through 190 )	B	G	141 - 190	143 - 192
9	9	chain 'B' and (resid 191 through 208 )	B	G	191 - 208	193 - 210
10	10	chain 'B' and (resid 209 through 235 )	B	G	209 - 235	211 - 237
11	11	chain 'B' and (resid 236 through 236 )	B	G	236	238 - 245
12	12	chain 'C' and (resid 3 through 76 )	C	L	3 - 76	1 - 74
13	13	chain 'C' and (resid 77 through 117 )	C	L	77 - 117	75 - 115
14	14	chain 'C' and (resid 118 through 165 )	C	L	118 - 165	116 - 163
15	15	chain 'C' and (resid 166 through 236 )	C	L	166 - 236	164 - 241
16	16	chain 'D' and (resid 4 through 117 )	D	P	4 - 117	1 - 114
17	17	chain 'D' and (resid 118 through 165 )	D	P	118 - 165	115 - 162
18	18	chain 'D' and (resid 166 through 190 )	D	P	166 - 190	163 - 187
19	19	chain 'D' and (resid 191 through 236 )	D	P	191 - 236	188 - 240
20	20	chain 'E' and (resid 4 through 41 )	E	R	4 - 41	1 - 38
21	21	chain 'E' and (resid 42 through 76 )	E	R	42 - 76	39 - 73
22	22	chain 'E' and (resid 77 through 117 )	E	R	77 - 117	74 - 114
23	23	chain 'E' and (resid 118 through 165 )	E	R	118 - 165	115 - 162
24	24	chain 'E' and (resid 166 through 236 )	E	R	166 - 236	163 - 240
25	25	chain 'F' and (resid 1 through 18 )	F	X	1 - 18	1 - 18
26	26	chain 'F' and (resid 19 through 76 )	F	X	19 - 76	19 - 76
27	27	chain 'F' and (resid 77 through 117 )	F	X	77 - 117	77 - 117
28	28	chain 'F' and (resid 118 through 206 )	F	X	118 - 206	118 - 206
29	29	chain 'F' and (resid 207 through 236 )	F	X	207 - 236	207 - 243
30	30	chain 'G' and (resid 1 through 17 )	G	M	1 - 17	1 - 17
31	31	chain 'G' and (resid 18 through 34 )	G	M	18 - 34	18 - 34
32	32	chain 'G' and (resid 35 through 76 )	G	M	35 - 76	35 - 76
33	33	chain 'G' and (resid 77 through 117 )	G	M	77 - 117	77 - 117
34	34	chain 'G' and (resid 118 through 140 )	G	M	118 - 140	118 - 140
35	35	chain 'G' and (resid 141 through 165 )	G	M	141 - 165	141 - 165
36	36	chain 'G' and (resid 166 through 190 )	G	M	166 - 190	166 - 190
37	37	chain 'G' and (resid 191 through 214 )	G	M	191 - 214	191 - 214
38	38	chain 'G' and (resid 215 through 237 )	G	M	215 - 237	215 - 244
39	39	chain 'H' and (resid 4 through 75 )	H	O	4 - 75	1 - 72
40	40	chain 'H' and (resid 76 through 109 )	H	O	76 - 109	73 - 106
41	41	chain 'H' and (resid 110 through 190 )	H	O	110 - 190	107 - 187
42	42	chain 'H' and (resid 191 through 236 )	H	O	191 - 236	188 - 240
43	43	chain 'I' and (resid 3 through 140 )	I	Q	3 - 140	1 - 138
44	44	chain 'I' and (resid 141 through 237 )	I	Q	141 - 237	139 - 242
45	45	chain 'J' and (resid 4 through 41 )	J	S	4 - 41	1 - 38
46	46	chain 'J' and (resid 42 through 76 )	J	S	42 - 76	39 - 73
47	47	chain 'J' and (resid 77 through 109 )	J	S	77 - 109	74 - 106
48	48	chain 'J' and (resid 110 through 117 )	J	S	110 - 117	107 - 114
49	49	chain 'J' and (resid 118 through 190 )	J	S	118 - 190	115 - 187
50	50	chain 'J' and (resid 191 through 207 )	J	S	191 - 207	188 - 204
51	51	chain 'J' and (resid 208 through 214 )	J	S	208 - 214	205 - 211
52	52	chain 'J' and (resid 215 through 236 )	J	S	215 - 236	212 - 240

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