PDB-3q6n: Crystal Structure of Human MC-HSP90 in P21 space group

ID or keywords:

Entry

Database: PDB / ID: 3q6n

Title

Crystal Structure of Human MC-HSP90 in P21 space group

Components

Heat shock protein HSP 90-alpha

Keywords

CHAPERONE / three domains / trimer of dimer / hexamer

Function / homology

Function and homology information

positive regulation of tau-protein kinase activity / sperm mitochondrial sheath / dATP binding / Scavenging by Class F Receptors / sulfonylurea receptor binding / CTP binding / positive regulation of protein polymerization / vRNP Assembly / UTP binding / sperm plasma membrane ...positive regulation of tau-protein kinase activity / sperm mitochondrial sheath / dATP binding / Scavenging by Class F Receptors / sulfonylurea receptor binding / CTP binding / positive regulation of protein polymerization / vRNP Assembly / UTP binding / sperm plasma membrane / protein insertion into mitochondrial outer membrane / chaperone-mediated autophagy / telomerase holoenzyme complex assembly / Respiratory syncytial virus genome replication / Rho GDP-dissociation inhibitor binding / Uptake and function of diphtheria toxin / mitochondrial transport / Drug-mediated inhibition of ERBB2 signaling / Resistance of ERBB2 KD mutants to trastuzumab / Resistance of ERBB2 KD mutants to sapitinib / Resistance of ERBB2 KD mutants to tesevatinib / Resistance of ERBB2 KD mutants to neratinib / Resistance of ERBB2 KD mutants to osimertinib / Resistance of ERBB2 KD mutants to afatinib / Resistance of ERBB2 KD mutants to AEE788 / Resistance of ERBB2 KD mutants to lapatinib / Drug resistance in ERBB2 TMD/JMD mutants / PIWI-interacting RNA (piRNA) biogenesis / TPR domain binding / non-chaperonin molecular chaperone ATPase / Assembly and release of respiratory syncytial virus (RSV) virions / dendritic growth cone / regulation of postsynaptic membrane neurotransmitter receptor levels / Sema3A PAK dependent Axon repulsion / regulation of protein ubiquitination / skeletal muscle contraction / telomere maintenance via telomerase / protein unfolding / HSF1-dependent transactivation / response to unfolded protein / positive regulation of cell size / chaperone-mediated protein complex assembly / regulation of protein-containing complex assembly / HSF1 activation / Attenuation phase / RHOBTB2 GTPase cycle / positive regulation of defense response to virus by host / eNOS activation / positive regulation of lamellipodium assembly / axonal growth cone / DNA polymerase binding / activation of innate immune response / Tetrahydrobiopterin (BH4) synthesis, recycling, salvage and regulation / Loss of Nlp from mitotic centrosomes / Loss of proteins required for interphase microtubule organization from the centrosome / Recruitment of mitotic centrosome proteins and complexes / Signaling by ERBB2 / response to salt stress / cardiac muscle cell apoptotic process / endocytic vesicle lumen / Recruitment of NuMA to mitotic centrosomes / Anchoring of the basal body to the plasma membrane / positive regulation of cardiac muscle contraction / HSP90 chaperone cycle for steroid hormone receptors (SHR) in the presence of ligand / nitric-oxide synthase regulator activity / positive regulation of interferon-beta production / response to cold / protein tyrosine kinase binding / AURKA Activation by TPX2 / Constitutive Signaling by Overexpressed ERBB2 / lysosomal lumen / ESR-mediated signaling / VEGFR2 mediated vascular permeability / response to cocaine / ATP-dependent protein folding chaperone / Signaling by ERBB2 TMD/JMD mutants / brush border membrane / neuron migration / Constitutive Signaling by EGFRvIII / Signaling by ERBB2 ECD mutants / DDX58/IFIH1-mediated induction of interferon-alpha/beta / Signaling by ERBB2 KD Mutants / tau protein binding / Regulation of necroptotic cell death / cellular response to virus / Regulation of actin dynamics for phagocytic cup formation / Downregulation of ERBB2 signaling / VEGFA-VEGFR2 Pathway / histone deacetylase binding / positive regulation of protein import into nucleus / Aggrephagy / Chaperone Mediated Autophagy / response to estrogen / positive regulation of protein catabolic process / The role of GTSE1 in G2/M progression after G2 checkpoint / disordered domain specific binding / Regulation of PLK1 Activity at G2/M Transition / positive regulation of nitric oxide biosynthetic process / unfolded protein binding / melanosome
Similarity search - Function

Biological species

Homo sapiens (human)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 3.05 Å

Authors

Lee, C.C. / Lin, T.W. / Ko, T.P. / Wang, A.H.-J.

Citation

Journal: Plos One / Year: 2011
Title: The hexameric structures of human heat shock protein 90
Authors: Lee, C.C. / Lin, T.W. / Ko, T.P. / Wang, A.H.-J.

History

Deposition	Jan 3, 2011	Deposition site: RCSB / Processing site: PDBJ
Revision 1.0	Jun 1, 2011	Provider: repository / Type: Initial release
Revision 1.1	Jul 13, 2011	Group: Version format compliance
Revision 1.2	Mar 5, 2014	Group: Database references
Revision 1.3	Nov 1, 2023	Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / struct_ref_seq_dif / struct_site Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_ref_seq_dif.details / _struct_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_seq_id

Structure viewer	Molecule: MolmilJmol/JSmol

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Validation report

Summary document	3q6n_validation.pdf.gz	504.2 KB	Display	wwPDB validaton report
Full document	3q6n_full_validation.pdf.gz	551.7 KB	Display
Data in XML	3q6n_validation.xml.gz	78 KB	Display
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Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/q6/3q6n ftp://data.pdbj.org/pub/pdb/validation_reports/q6/3q6n	HTTPS FTP

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Related structure data

Related structure data	3q6mSC S: Starting model for refinement C: citing same article (ref.)
Similar structure data	3q6m-1 6p4o-d 2cge-1 30231 22557 5hys-d Search similar-shape structures by Omokage search (details) 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	#32 - Aug 2002 Chaperones similarity (1) #126 - Jun 2010 Epidermal Growth Factor similarity (12) #108 - Dec 2008 Hsp90 similarity (6) #44 - Aug 2003 Calmodulin similarity (3) #148 - Apr 2012 Ras Protein similarity (1) #245 - May 2020 Spliceosomes similarity (2) #45 - Sep 2003 Estrogen Receptor similarity (1) #196 - Apr 2016 Lead Poisoning similarity (3) #28 - Apr 2002 Anthrax Toxin similarity (3) #69 - Sep 2005 Cholera Toxin similarity (1) #122 - Feb 2010 Enhanceosome similarity (1) #188 - Aug 2015 Tetrahydrobiopterin Biosynthesis similarity (2) #258 - Jun 2021 Glucocorticoid Receptor and Dexamethasone similarity (1) #92 - Aug 2007 Anabolic Steroids similarity (1) #127 - Jul 2010 Crystallins similarity (1) #206 - Feb 2017 Globin Evolution similarity (1) #34 - Oct 2002 Dihydrofolate Reductase similarity (1) #43 - Jul 2003 Src Tyrosine Kinase similarity (1) #60 - Dec 2004 Ubiquitin similarity (1) #195 - Mar 2016 RAF Protein Kinases similarity (1)

PDB pages

PDBj /

wwPDB /

NCBI

Related items in Molecule of the Month

#32 - Aug 2002
Chaperones
similarity (1)
#126 - Jun 2010
Epidermal Growth Factor
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Calmodulin
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#148 - Apr 2012
Ras Protein
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#245 - May 2020
Spliceosomes
similarity (2)
#45 - Sep 2003
Estrogen Receptor
similarity (1)
#196 - Apr 2016
Lead Poisoning
similarity (3)
#28 - Apr 2002
Anthrax Toxin
similarity (3)
#69 - Sep 2005
Cholera Toxin
similarity (1)
#122 - Feb 2010
Enhanceosome
similarity (1)
#188 - Aug 2015
Tetrahydrobiopterin Biosynthesis
similarity (2)
#258 - Jun 2021
Glucocorticoid Receptor and Dexamethasone
similarity (1)
#92 - Aug 2007
Anabolic Steroids
similarity (1)
#127 - Jul 2010
Crystallins
similarity (1)
#206 - Feb 2017
Globin Evolution
similarity (1)
#34 - Oct 2002
Dihydrofolate Reductase
similarity (1)
#43 - Jul 2003
Src Tyrosine Kinase
similarity (1)
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Ubiquitin
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Deposited unit

A: Heat shock protein HSP 90-alpha

B: Heat shock protein HSP 90-alpha

C: Heat shock protein HSP 90-alpha

D: Heat shock protein HSP 90-alpha

E: Heat shock protein HSP 90-alpha

F: Heat shock protein HSP 90-alpha

hetero molecules

315 kDa, 6 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

Idetical with deposited unit
defined by author

Unit cell

Length a, b, c (Å)	157.897, 90.868, 167.093
Angle α, β, γ (deg.)	90.00, 115.85, 90.00
Int Tables number	4
Space group name H-M	P12₁1

#1: Protein	Heat shock protein HSP 90-alpha / Heat shock 86 kDa / HSP 86 / HSP86 / Renal carcinoma antigen NY-REN-38 Mass: 52371.547 Da / Num. of mol.: 6 Fragment: Middle and C-terminal domain, UNP residues 293-732 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Homo sapiens (human) / Gene: HSP90AA1, HSP90A, HSPC1, HSPCA / Plasmid: pGEX-6p-1 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) / References: UniProt: P07900
#2: Chemical	ChemComp-SO4 / SULFATE ION Mass: 96.063 Da / Num. of mol.: 6 / Source method: obtained synthetically / Formula: SO₄
#3: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 277 / Source method: isolated from a natural source / Formula: H₂O

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Experiment

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

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Sample preparation

Crystal	Density Matthews: 3.43 Å³/Da / Density % sol: 64.17 %
Crystal grow	Temperature: 298 K / Method: vapor diffusion, sitting drop Details: 1.0M ammonium sulfate, 0.04M Tris-sodium citrate, 0.04 mM cisplatin, pH 5.4-5.8, VAPOR DIFFUSION, SITTING DROP, temperature 298K PH range: 5.4-5.8

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: Photon Factory / Beamline: AR-NW12A / Wavelength: 1 Å
Detector	Type: ADSC QUANTUM 210 / Detector: CCD / Date: May 24, 2009
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 1 Å / Relative weight: 1
Reflection	Resolution: 3.05→30 Å / Num. all: 83280 / Num. obs: 82281 / % possible obs: 98.8 % / Observed criterion σ(F): 0 / Observed criterion σ(I): 1 / Redundancy: 3.5 % / R_merge(I) obs: 0.058 / Net I/σ(I): 19.6
Reflection shell	Resolution: 3.05→3.16 Å / Redundancy: 3.5 % / R_merge(I) obs: 0.362 / Mean I/σ(I) obs: 5.1 / % possible all: 99.4

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Processing

Software

Name	Version	Classification
MOLREP		phasing
CNS	1.2	refinement
HKL-2000		data reduction
HKL-2000		data scaling
REFMAC	5.5.0109	refinement

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: PDB ENTRY 3Q6M

3q6m

Resolution: 3.05→30 Å / Cor.coef. F_o:F_c: 0.93 / Cor.coef. F_o:F_c free: 0.888 / SU B: 37.284 / SU ML: 0.305 / Cross valid method: THROUGHOUT / ESU R: 1.38 / ESU R Free: 0.394 / Stereochemistry target values: MAXIMUM LIKELIHOOD
Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS U VALUES: WITH TLS ADDED

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.25921	4017	5 %	RANDOM
R_work	0.20447	-	-	-
obs	0.20721	76434	98.69 %	-
all	-	77861	-	-

Solvent computation

Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.4 Å / Solvent model: MASK

Displacement parameters

B_iso mean: 85.835 Å²

	B_aniso -1	B_aniso -2
1-	0 Å²	0 Å²
2-	-	0 Å²
3-	-	-

Refinement step

Cycle: LAST / Resolution: 3.05→30 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	17827	0	30	277	18134

Refine LS restraints

Refine-ID	Type	Dev ideal	Dev ideal target	Number
X-RAY DIFFRACTION	r_bond_refined_d	0.012	0.022	18146
X-RAY DIFFRACTION	r_bond_other_d
X-RAY DIFFRACTION	r_angle_refined_deg	1.398	1.978	24363
X-RAY DIFFRACTION	r_angle_other_deg
X-RAY DIFFRACTION	r_dihedral_angle_1_deg	6.54	5	2132
X-RAY DIFFRACTION	r_dihedral_angle_2_deg	38.234	24.893	887
X-RAY DIFFRACTION	r_dihedral_angle_3_deg	20.651	15	3662
X-RAY DIFFRACTION	r_dihedral_angle_4_deg	18.735	15	104
X-RAY DIFFRACTION	r_chiral_restr	0.099	0.2	2704
X-RAY DIFFRACTION	r_gen_planes_refined	0.005	0.02	13253
X-RAY DIFFRACTION	r_gen_planes_other
X-RAY DIFFRACTION	r_nbd_refined
X-RAY DIFFRACTION	r_nbd_other
X-RAY DIFFRACTION	r_nbtor_refined
X-RAY DIFFRACTION	r_nbtor_other
X-RAY DIFFRACTION	r_xyhbond_nbd_refined
X-RAY DIFFRACTION	r_xyhbond_nbd_other
X-RAY DIFFRACTION	r_metal_ion_refined
X-RAY DIFFRACTION	r_metal_ion_other
X-RAY DIFFRACTION	r_symmetry_vdw_refined
X-RAY DIFFRACTION	r_symmetry_vdw_other
X-RAY DIFFRACTION	r_symmetry_hbond_refined
X-RAY DIFFRACTION	r_symmetry_hbond_other
X-RAY DIFFRACTION	r_symmetry_metal_ion_refined
X-RAY DIFFRACTION	r_symmetry_metal_ion_other
X-RAY DIFFRACTION	r_mcbond_it	0.69	1.5	10750
X-RAY DIFFRACTION	r_mcbond_other
X-RAY DIFFRACTION	r_mcangle_it	1.339	2	17455
X-RAY DIFFRACTION	r_scbond_it	1.565	3	7396
X-RAY DIFFRACTION	r_scangle_it	2.882	4.5	6908
X-RAY DIFFRACTION	r_rigid_bond_restr
X-RAY DIFFRACTION	r_sphericity_free
X-RAY DIFFRACTION	r_sphericity_bonded

LS refinement shell

Resolution: 3.05→3.128 Å / Total num. of bins used: 20

	R_factor	Num. reflection	% reflection
R_free	0.33	305	-
R_work	0.274	5580	-
obs	-	-	99.24 %

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	4.6621	1.1749	2.3316	1.9262	-0.61	5.6594	-0.0432	-0.2022	0.6475	-0.1918	-0.1873	0.1134	-0.1261	0.5026	0.2305	0.6488	-0.124	-0.1644	1.1098	-0.1694	0.5791	-53.576	27.997	35.877
2	5.7744	0.1251	0.0306	3.3505	-0.6378	2.7053	-0.1404	-0.641	-0.096	0.1173	0.0584	-0.2123	0.2141	0.0845	0.082	0.6351	0.1244	-0.0141	1.0905	0.0563	0.4921	-36.872	-28.208	11.269
3	3.226	-0.6361	-0.4044	1.7035	1.141	6.6415	-0.3583	0.3711	-0.2786	-0.0089	-0.1862	-0.1211	0.3152	-0.0103	0.5445	0.6672	-0.0233	0.0367	1.163	-0.2475	0.4817	-52.599	-27.884	34.893
4	3.1452	-1.5511	-0.0154	2.5577	-1.6811	7.3386	-0.2069	0.2599	0.5116	-0.1153	0.0348	-0.0627	-0.1538	-0.1667	0.1721	0.6657	0.0068	-0.1407	0.9995	0.1083	0.589	-25.59	27.575	33.357
5	3.4971	1.4096	-0.1495	3.8431	-1.0471	5.2565	0.1067	0.0758	-0.3173	0.1656	0.1744	0.1575	0.2489	-0.128	-0.2811	0.7795	-0.0058	-0.1102	0.8234	0.0763	0.6255	-24.54	-27.496	38.189
6	5.256	-0.0722	0.3184	3.314	1.0601	2.7955	-0.1503	-0.312	0.3444	0.1876	0.0864	0.1412	-0.0478	-0.0493	0.0639	0.7814	0.0644	-0.1454	0.8361	0.029	0.5559	-42.044	27.339	9.882
7	17.4677	5.758	10.7585	2.3889	-0.5318	7.4646	0.4954	-0.5478	-0.9193	-0.505	-0.2535	-0.453	0.2285	-0.0086	-0.2419	0.4824	0.0052	-0.3014	1.1668	-0.0894	0.7102	-50.851	16.865	40.026
8	9.8016	-2.5424	5.6383	3.3787	-1.4517	6.2531	-0.2275	-0.6425	0.7975	0.4578	0.0215	0.0332	-0.4018	0.0739	0.206	0.6239	0.0323	-0.1612	1.0762	-0.1374	0.6769	-32.598	-16.594	12.483
9	-3.815	-2.8935	-1.4863	7.523	3.6734	35.7082	-0.2217	0.3119	0.5009	-0.1752	-1.1278	-1.1362	-1.4117	-0.3878	1.3494	0.7696	0.1337	0.018	1.3248	0.0841	0.1698	-54.768	-16.733	30.535
10	2.5836	-1.3738	2.7839	2.3616	-3.7786	17.8235	0.0223	0.1789	-0.1785	-0.4432	-0.443	0.4755	1.1851	0.0979	0.4207	0.9324	-0.0203	-0.1645	1.0312	-0.0095	0.4211	-24.002	16.187	28.861
11	15.3873	4.3006	-7.0365	3.3371	0.4601	2.1496	0.2751	-0.6427	0.788	-0.3863	-0.135	0.2042	-0.2714	0.1872	-0.1401	0.7242	0.0533	-0.1028	0.9192	0.0919	0.7185	-27.255	-15.309	40.757
12	15.5082	0.8051	-8.007	3.0708	3.264	4.5816	0.0421	-0.1535	-0.6775	0.3603	-0.1604	-0.016	0.3059	-0.1004	0.1183	0.8264	0.0283	-0.0714	0.8509	0.1534	0.6282	-46.576	15.78	10.941
13	5.7039	1.9819	2.7349	-0.6839	0.9371	2.8	0.1939	-0.4407	0.1227	-0.0698	-0.1462	0.0364	0.1811	-0.0759	-0.0476	0.7778	-0.058	-0.3042	0.8759	-0.0557	0.7512	-78.378	15.629	28.385
14	5.6949	-1.962	2.4896	1.413	-1.1787	2.314	0.0372	0.1936	0.3498	-0.1081	-0.1018	-0.0005	0.1848	0.1933	0.0646	0.65	0.009	-0.0591	0.8769	0.0626	0.6305	-54.812	-15.823	-7.867
15	1.0996	0.0916	-0.4984	0.165	2.3331	7.9584	-0.1316	0.1184	0.022	0.0335	-0.2879	-0.0469	-0.0424	-0.4754	0.4195	0.8691	0.1275	-0.1071	1.0204	-0.0986	0.4565	-59.601	-15.628	59.976
16	0.8273	0.298	0.509	1.1475	-1.9103	7.9346	-0.0872	0.0341	-0.0154	0.021	-0.2902	-0.058	0.1217	0.3529	0.3775	0.7134	0.1003	-0.0988	1.0109	0.069	0.5242	-17.746	15.657	58.448
17	6.2535	2.6956	-3.5365	0.1364	-1.3701	3.0354	0.1345	-0.433	-0.113	-0.1208	-0.1738	-0.0207	-0.0933	0.2859	0.0393	0.7097	0.0203	-0.0206	0.8511	0.1553	0.7942	0.452	-15.116	29.382
18	4.3124	-2.0704	-2.684	1.6957	1.0653	1.8003	-0.0337	0.1703	-0.1863	-0.2148	-0.031	0.0145	-0.1824	-0.0734	0.0647	0.81	-0.0368	-0.0448	0.8802	0.0002	0.6056	-23.502	14.802	-8.693
19	5.4565	0.771	2.7201	2.5019	0.6271	1.2142	0.3995	-0.5191	-0.2622	0.4959	-0.3063	-0.1325	0.3514	-0.2531	-0.0931	0.8313	-0.2472	-0.118	0.9167	0.0044	0.6509	-96.347	-2.179	16.259
20	2.2085	-0.8124	0.3882	2.1684	0.3865	5.8149	0.466	0.5585	0.6007	-0.2041	-0.0735	-0.5287	-0.0639	-0.152	-0.3925	0.6302	0.199	0.0399	0.9071	0.4057	0.9175	-72.443	2.347	-18.706
21	1.3509	0.887	-1.5168	2.1686	1.9212	4.3771	-0.0133	0.1058	0.0928	-0.3349	-0.6614	0.3214	-0.5993	-0.5356	0.6747	0.8332	0.1753	-0.1964	1.0511	-0.2256	0.6028	-58.051	3.256	81.358
22	2.3971	1.1277	0.0741	2.6512	-1.6189	3.6929	-0.1884	-0.3906	-0.3457	-0.3634	-0.2496	-0.406	0.3419	0.2011	0.438	0.7847	0.2041	-0.0654	0.9996	0.3053	0.6354	-18.55	-2.762	78.833
23	5.9121	0.3004	-2.4306	2.4477	-3.2991	2.177	0.3024	-0.806	-0.1571	0.4647	-0.4089	0.303	-0.7164	0.7485	0.1065	0.6978	-0.2386	-0.0106	1.1324	0.0307	0.657	18.094	2.087	16.165
24	3.1502	-1.9999	-2.9645	2.3484	-0.9478	4.4322	0.0358	0.51	-0.5555	-0.0167	0.1527	0.4986	0.0318	-0.132	-0.1885	0.6997	0.0083	-0.0715	0.9127	-0.2557	0.8151	-5.833	-4.338	-16.374
25	4.1485	0.0442	-0.6137	1.7855	-0.546	2.6641	0.3266	0.1417	0.1835	0.0353	-0.1998	-0.2289	0.5347	-0.099	-0.1269	0.748	-0.0395	-0.1913	0.7734	-0.0236	0.7297	-93.163	-5.094	1.526
26	3.5154	-0.4539	-2.9586	0.7034	-0.347	2.5561	0.5078	0.4384	0.9489	0.0857	-0.3768	-0.3282	-0.0878	-0.3619	-0.131	0.6257	0.1691	-0.0568	0.8989	0.2755	0.9893	-85.016	4.815	-10.353
27	3.2711	-1.1919	-0.4186	0.7191	0.2961	2.7413	-0.1181	-0.1912	0.2961	-0.2272	-0.374	-0.2311	-0.1606	-0.1847	0.4921	0.9861	-0.0318	-0.1307	0.8575	-0.0796	0.5572	-45.584	5.236	86.703
28	4.8929	-0.2678	-1.9197	0.651	0.0231	1.7391	-0.1547	-0.1476	-0.4294	0.1149	-0.462	0.0611	0.4638	0.2536	0.6166	0.9789	0.0653	0.0317	0.892	0.2174	0.6052	-30.645	-4.604	86.462
29	2.7323	1.4729	0.5513	2.153	0.4926	2.1554	0.0692	0.0773	-0.1165	0.0018	0.0287	0.2198	-0.2554	0.2914	-0.098	0.6457	-0.0659	0.0628	0.9436	0.0987	0.732	14.855	4.059	1.628
30	4.069	-0.5779	1.3838	1.5919	0.3594	2.8745	0.2288	0.1889	-0.4929	0.0486	-0.2918	0.0169	0.2491	0.1913	0.063	0.6777	0.1012	0.003	0.869	-0.0609	0.8527	6.325	-6.147	-9.862

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Auth asym-ID	Auth seq-ID
1	X-RAY DIFFRACTION	1	A	297 - 349
2	X-RAY DIFFRACTION	2	B	297 - 349
3	X-RAY DIFFRACTION	3	C	297 - 349
4	X-RAY DIFFRACTION	4	D	297 - 349
5	X-RAY DIFFRACTION	5	E	297 - 348
6	X-RAY DIFFRACTION	6	F	297 - 349
7	X-RAY DIFFRACTION	7	A	360 - 393
8	X-RAY DIFFRACTION	8	B	358 - 394
9	X-RAY DIFFRACTION	9	C	360 - 393
10	X-RAY DIFFRACTION	10	D	360 - 394
11	X-RAY DIFFRACTION	11	E	358 - 394
12	X-RAY DIFFRACTION	12	F	358 - 395
13	X-RAY DIFFRACTION	13	A	407 - 552
14	X-RAY DIFFRACTION	14	B	408 - 552
15	X-RAY DIFFRACTION	15	C	407 - 552
16	X-RAY DIFFRACTION	16	D	407 - 552
17	X-RAY DIFFRACTION	17	E	408 - 552
18	X-RAY DIFFRACTION	18	F	408 - 552
19	X-RAY DIFFRACTION	19	A	553 - 611
20	X-RAY DIFFRACTION	20	B	553 - 611
21	X-RAY DIFFRACTION	21	C	557 - 611
22	X-RAY DIFFRACTION	22	D	556 - 613
23	X-RAY DIFFRACTION	23	E	553 - 611
24	X-RAY DIFFRACTION	24	F	557 - 614
25	X-RAY DIFFRACTION	25	A	631 - 698
26	X-RAY DIFFRACTION	26	B	631 - 698
27	X-RAY DIFFRACTION	27	C	631 - 696
28	X-RAY DIFFRACTION	28	D	631 - 698
29	X-RAY DIFFRACTION	29	E	631 - 697
30	X-RAY DIFFRACTION	30	F	630 - 698

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