PDB-4ix5: Crystal structure of a Stt7 homolog from Micromonas algae in comp...

ID or keywords:

Entry

Database: PDB / ID: 4ix5

Title

Crystal structure of a Stt7 homolog from Micromonas algae in complex with AMP-PNP

Components

MsStt7d protein

Keywords

TRANSFERASE / protein kinase / canonical protein kinase fold / ATP binding

Function / homology

Function and homology information

protein kinase activity / ATP binding / metal ion binding
Similarity search - Function

Biological species

Micromonas (plant)

Method

X-RAY DIFFRACTION /

SYNCHROTRON / Difference Fourier / Resolution: 1.7 Å

Authors

Guo, J. / Wei, X. / Li, M. / Pan, X. / Chang, W. / Liu, Z.

Citation

Journal: Protein Cell / Year: 2013
Title: Structure of the catalytic domain of a state transition kinase homolog from Micromonas algae
Authors: Guo, J. / Wei, X. / Li, M. / Pan, X. / Chang, W. / Liu, Z.

History

Deposition	Jan 24, 2013	Deposition site: RCSB / Processing site: PDBJ
Revision 1.0	Oct 2, 2013	Provider: repository / Type: Initial release
Revision 1.1	Mar 20, 2024	Group: Data collection / Database references / Derived calculations Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_struct_conn_angle / struct_conn / 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 / _pdbx_struct_conn_angle.ptnr1_auth_asym_id / _pdbx_struct_conn_angle.ptnr1_auth_comp_id / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr1_label_asym_id / _pdbx_struct_conn_angle.ptnr1_label_atom_id / _pdbx_struct_conn_angle.ptnr1_label_comp_id / _pdbx_struct_conn_angle.ptnr1_label_seq_id / _pdbx_struct_conn_angle.ptnr2_auth_asym_id / _pdbx_struct_conn_angle.ptnr2_auth_seq_id / _pdbx_struct_conn_angle.ptnr2_label_asym_id / _pdbx_struct_conn_angle.ptnr3_auth_asym_id / _pdbx_struct_conn_angle.ptnr3_auth_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_label_asym_id / _pdbx_struct_conn_angle.ptnr3_label_atom_id / _pdbx_struct_conn_angle.ptnr3_label_comp_id / _pdbx_struct_conn_angle.ptnr3_label_seq_id / _pdbx_struct_conn_angle.value / _struct_conn.pdbx_dist_value / _struct_conn.ptnr1_auth_asym_id / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_asym_id / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id / _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	4ix5_validation.pdf.gz	1.2 MB	Display	wwPDB validaton report
Full document	4ix5_full_validation.pdf.gz	1.2 MB	Display
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Data in CIF	4ix5_validation.cif.gz	50.7 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/ix/4ix5 ftp://data.pdbj.org/pub/pdb/validation_reports/ix/4ix5	HTTPS FTP

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Related structure data

Related structure data	4ix3C 4ix4C 4ix6C C: citing same article (ref.)
Similar structure data	4ix3-d 4ix4-d 4ix6-d 2rus-d 5rub-d 1rba-d 2iah-d 3dlx-1 4kgb-d 5egw-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	#108 - Dec 2008 Hsp90 similarity (1) #168 - Dec 2013 DNA Helicase similarity (1) #182 - Feb 2015 Insulin receptor similarity (1) #214 - Oct 2017 Chimeric Antigen Receptors similarity (1) #238 - Oct 2019 Ribonucleotide Reductase similarity (1) #43 - Jul 2003 Src Tyrosine Kinase similarity (1) #50 - Feb 2004 Glycolytic Enzymes similarity (1) #60 - Dec 2004 Ubiquitin similarity (1) #73 - Jan 2006 Topoisomerase similarity (1) #80 - Aug 2006 AAA+ Proteases similarity (1) #95 - Nov 2007 Multidrug Resistance Transporters similarity (1)

PDB pages

PDBj /

wwPDB /

NCBI

Related items in Molecule of the Month

#108 - Dec 2008
Hsp90
similarity (1)
#168 - Dec 2013
DNA Helicase
similarity (1)
#182 - Feb 2015
Insulin receptor
similarity (1)
#214 - Oct 2017
Chimeric Antigen Receptors
similarity (1)
#238 - Oct 2019
Ribonucleotide Reductase
similarity (1)
#43 - Jul 2003
Src Tyrosine Kinase
similarity (1)
#50 - Feb 2004
Glycolytic Enzymes
similarity (1)
#60 - Dec 2004
Ubiquitin
similarity (1)
#73 - Jan 2006
Topoisomerase
similarity (1)
#80 - Aug 2006
AAA+ Proteases
similarity (1)
#95 - Nov 2007
Multidrug Resistance Transporters
similarity (1)

Deposited unit

A: MsStt7d protein

B: MsStt7d protein

hetero molecules

76.6 kDa, 2 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)	53.860, 132.610, 55.180
Angle α, β, γ (deg.)	90.00, 116.64, 90.00
Int Tables number	4
Space group name H-M	P12₁1

#1: Protein	MsStt7d protein Mass: 37732.906 Da / Num. of mol.: 2 / Fragment: UNP residues 151-489 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Micromonas (plant) / Strain: RCC299 / Gene: STT7 / Plasmid: pET28a / Production host: Escherichia coli (E. coli) / Strain (production host): BL21 (DE3) / References: UniProt: C1EBN1
#2: Chemical	ChemComp-MG / MAGNESIUM ION Mass: 24.305 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: Mg
#3: Chemical	ChemComp-ANP / PHOSPHOAMINOPHOSPHONIC ACID-ADENYLATE ESTER Mass: 506.196 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: C₁₀H₁₇N₆O₁₂P₃ / Comment: AMP-PNP, energy-carrying molecule analogue*YM
#4: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 625 / 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: 2.33 Å³/Da / Density % sol: 47.3 %
Crystal grow	Temperature: 291 K / Method: vapor diffusion, hanging drop / pH: 7.5 Details: 100mM HEPES, 200mM MgCl2, 25% PEG3350, pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 291K

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: SSRF / Beamline: BL17U / Wavelength: 0.97854 Å
Detector	Type: ADSC QUANTUM 315r / Detector: CCD / Date: Oct 29, 2011
Radiation	Monochromator: double crystal / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.97854 Å / Relative weight: 1
Reflection	Resolution: 1.7→33.15 Å / Num. all: 76423 / Num. obs: 75812 / % possible obs: 99.2 % / Observed criterion σ(F): 1.4 / Observed criterion σ(I): 2 / Redundancy: 7.2 % / B_iso Wilson estimate: 28.3 Å² / R_merge(I) obs: 0.081 / Net I/σ(I): 14.8
Reflection shell	Resolution: 1.7→1.79 Å / Redundancy: 7.2 % / R_merge(I) obs: 0.474 / Mean I/σ(I) obs: 4.1 / Num. unique all: 11076 / % possible all: 100

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Processing

Software

Name	Version	Classification
HKL-2000		data collection
PHENIX		model building
PHENIX	(phenix.refine: 1.6.4_486)	refinement
MOSFLM		data reduction
SCALA		data scaling
PHENIX		phasing

Refinement

Method to determine structure: Difference Fourier / Resolution: 1.7→28.628 Å / SU ML: 0.19 / σ(F): 0 / Phase error: 20.17 / Stereochemistry target values: ML

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.2013	3735	5.04 %	RANDOM
R_work	0.1725	-	-	-
all	0.1779	75801	-	-
obs	0.1739	74080	97.73 %	-

Solvent computation

Shrinkage radii: 0.95 Å / VDW probe radii: 1.2 Å / Solvent model: FLAT BULK SOLVENT MODEL / B_sol: 40.726 Å² / k_sol: 0.342 e/Å³

Displacement parameters

B_iso mean: 26.5682 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	1.2773 Å²	0 Å²	-5.4573 Å²
2-	-	-3.0134 Å²	-0 Å²
3-	-	-	1.7361 Å²

Refinement step

Cycle: LAST / Resolution: 1.7→28.628 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	5246	0	65	625	5936

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.006	5463
X-RAY DIFFRACTION	f_angle_d	0.999	7318
X-RAY DIFFRACTION	f_chiral_restr	0.067	792
X-RAY DIFFRACTION	f_plane_restr	0.004	974
X-RAY DIFFRACTION	f_dihedral_angle_d	12.673	1984

LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 10

Resolution (Å)	R_factor R_free	Num. reflection R_free	R_factor R_work	Num. reflection R_work	Num. reflection all	% reflection obs (%)
1.7-1.7608	0.2744	336	0.207	6703	7039	93
1.7608-1.8312	0.235	363	0.1939	6787	7150	95
1.8312-1.9146	0.232	370	0.1838	6901	7271	96
1.9146-2.0155	0.2266	365	0.1784	7034	7399	98
2.0155-2.1417	0.2043	378	0.168	7084	7462	99
2.1417-2.307	0.2052	346	0.1707	7134	7480	99
2.307-2.5391	0.211	429	0.1724	7067	7496	99
2.5391-2.9062	0.2277	372	0.1871	7180	7552	99
2.9062-3.6602	0.1903	397	0.176	7198	7595	100
3.6602-28.6316	0.1631	379	0.1531	7257	7636	100

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	0.001	-0.0004	-0.0031	0.0005	0.0034	0.0224	-0.0109	-0.0047	-0.0015	-0.0221	-0.0014	0.0005	-0.0305	-0.0276	0.0093	0.4433	0.0921	0.0165	0.1291	0.0076	0.0961	64.3785	16.9662	35.0914
2	0.0299	0.0156	-0.0065	0.0283	-0.0078	0.0032	0.0161	-0.0475	-0.0009	-0.0196	-0.0382	-0.0076	0.0579	0.0337	0.0246	0.1613	0.0683	-0.0467	0.1707	0.0048	0.06	51.8125	35.9832	33.2665
3	0.299	0.0916	0.0383	0.0766	-0.0329	0.0441	-0.029	0.0373	-0.0487	0.0343	-0.0059	-0.0115	0.002	0.0203	0.0311	0.1527	-0.1022	-0.0139	0.2311	0.0448	0.1391	36.0856	36.0554	30.1739
4	0.1471	0.0034	0.0091	0.4026	-0.2246	0.1253	0.0733	0.0343	-0.044	-0.1153	0.0958	0.0246	0.0301	-0.0855	-0.0905	0.0267	-0.0181	0.0544	0.1351	0.002	0.0197	36.9676	40.0754	25.3655
5	0.1916	0.0108	0.1785	0.0005	0.0109	0.1668	0.0935	-0.0001	-0.106	-0.0322	0.0275	0.0329	0.0717	-0.0023	-0.1047	0.1417	-0.0246	-0.0148	0.0421	0.0011	0.087	43.2771	32.0337	18.0906
6	0.0045	0.0057	-0.0235	0.1052	0.0541	0.1988	-0.0234	-0.0061	-0.0869	0.0012	-0.0015	-0.0738	-0.0077	0.0573	0.0195	0.0399	-0.0074	-0.0083	0.0435	0.0085	0.1045	51.5041	35.2484	16.8238
7	0.0091	0.0324	0.0461	0.1671	0.2353	0.33	-0.0013	-0.0992	-0.0591	0.1237	-0.0166	-0.0322	0.0895	-0.0317	-0.0231	-0.0057	0.0146	-0.0977	0.0351	0.121	-0.3	48.3373	46.3806	24.9412
8	0.0624	-0.0016	0.0165	0.0126	-0.0032	0.0093	0.0083	0.0015	-0.004	0.0129	0.0085	-0.005	0.0074	-0.0099	-0.009	0.6855	-0.0846	-0.0852	0.6793	0.0904	0.7189	38.9806	25.4985	30.3566
9	0.0007	-0.0018	0.0026	0.0065	-0.0063	0.0043	-0.0129	-0.0083	-0.0177	0.0282	0.0132	0.0183	0.0544	-0.014	0.0013	0.1883	0.0038	0.0546	0.0598	0.0601	0.0483	41.453	30.7722	28.1806
10	0.003	0.0088	-0.0022	0.0396	-0.0009	-0.0007	-0.0341	0.086	0.0353	-0.0023	-0.0177	0.0294	0.0427	-0.0618	0.0162	-0.0607	-0.0537	0.114	0.0552	0.0896	-0.1028	36.8176	46.1069	23.4111
11	0.012	-0.0256	0.0401	0.082	-0.094	0.1758	-0.0212	-0.0538	0.1048	0.0043	0.0619	0.0608	-0.0055	-0.1542	-0.0266	0.0412	0.0083	0.0149	0.1373	0.004	0.1376	26.4456	56.5604	10.9661
12	0.3832	0.1306	-0.122	0.175	0.0411	0.2801	0.0301	-0.04	0.0708	-0.0198	-0.0006	0.047	-0.1178	0.0116	-0.0092	0.0177	-0.0058	-0.0106	0.005	0.0019	0.0211	40.9961	61.3383	11.5096
13	0.0461	0.0374	0.0358	0.0379	0.0308	0.0404	0.0022	-0.1048	-0.0425	0.0184	-0.0661	-0.0018	-0.0191	0.0094	0.0617	0.0258	-0.0174	0.0112	0.0966	0.0005	0.0476	40.4272	51.8404	14.878
14	0.0859	0.0267	-0.0269	0.0085	-0.0081	0.0052	-0.0113	-0.04	0.0123	-0.0165	-0.0158	-0.0884	0.0327	0.2439	0.0154	-0.2289	0.0025	0.0977	0.1026	0.0018	0.0307	57.2926	46.2509	11.3178
15	0.0562	0.046	-0.0972	0.0348	-0.0856	0.17	-0.0603	-0.0519	-0.0444	-0.0908	-0.018	-0.0732	0.1252	0.1945	0.0722	-0.1329	0.0594	0.1278	0.1362	-0.0439	-0.033	54.8053	46.8988	2.1542
16	0.015	0.0066	0.0014	0.0115	-0.0235	0.062	0.0152	0.0067	0.0199	-0.0112	-0.0146	-0.0354	-0.01	0.0108	-0.0043	-0.0571	-0.0608	0.0842	0.1466	0.111	0.0067	60.7046	55.4663	4.0062
17	0.1571	0.1813	0.1708	0.6442	0.4316	0.3207	-0.1179	0.152	0.0314	-0.3148	0.035	0.0695	-0.1525	0.0464	0.0674	0.0655	-0.0357	-0.0374	-0.0207	0.175	-0.3133	37.6982	54.9152	-4.0522
18	0.4069	0.3073	0.1552	0.4758	-0.061	0.2668	-0.1205	0.1301	0.1362	-0.2236	0.0252	0.0954	-0.0325	0.0608	0.0694	0.0929	-0.0215	-0.0436	0.0717	0.0408	0.0754	34.6546	62.0075	-6.0436
19	0.3364	0.3458	-0.0111	0.3577	-0.0153	0.5298	-0.0363	-0.0215	0.103	0.0151	-0.0697	0.0533	-0.1185	0.1102	0.0709	0.0648	-0.0209	0.0024	0.0758	0.033	0.0656	45.7083	65.1517	3.2762
20	0.027	-0.0044	0.0021	0.0181	-0.0084	0.0039	-0.0179	-0.0129	-0.0046	0.0005	0.0045	-0.0025	-0.0084	-0.0061	0.01	0.413	0.1102	0.039	0.4239	0.0717	0.3239	28.6539	82.4063	11.5351
21	0.115	0.0081	0.0848	0.1913	0.0457	0.0676	0.0516	0.0644	-0.0421	0.1118	0.0161	-0.0013	0.0941	0.0103	-0.0805	0.1474	-0.0293	-0.0636	0.0798	0.0314	0.0924	26.1199	38.956	-16.4703
22	0.0021	-0.0049	0.0003	0.0147	0.005	0.008	-0.0096	-0.0035	-0.0277	-0.0155	0.0194	0.0349	-0.0039	-0.0106	-0.0095	0.1399	0.0113	-0.076	0.1708	0.07	0.2501	16.3665	28.925	-2.6382
23	0.0151	0.0349	-0.0052	0.1128	0.0294	0.0554	0.0316	-0.0115	0.0167	-0.0019	0.0026	-0.0015	-0.0355	0.0259	-0.0249	0.3176	0.0067	0.0353	0.2034	-0.0613	0.2072	26.1821	29.9235	10.2236
24	0.0567	-0.0083	-0.0339	0.1233	0.112	0.2431	0.0046	-0.0319	-0.0297	0.0263	0.1229	0.1034	0.0014	-0.04	-0.1202	-0.0161	-0.0455	-0.0234	0.0406	0.0629	0.1307	24.7107	25.1534	4.2229
25	0.1374	0.1184	0.0641	0.3272	0.0246	0.167	0.0549	-0.0089	0.0225	-0.0476	0.0265	-0.1112	-0.0401	-0.0005	-0.0725	0.016	-0.0202	0.0375	0.0273	-0.0027	0.0932	36.0398	34.7793	2.2056
26	0.2435	-0.1995	0.016	0.2783	-0.1733	0.2251	0.0895	0.0391	0.0469	-0.134	-0.033	-0.0199	-0.0194	-0.0115	-0.0453	0.1352	0.0366	0.0266	0.0556	0.0131	0.0739	38.2335	29.0051	-5.2572
27	0.0141	0.0107	0.0008	0.4495	-0.4472	0.4359	0.0154	0.0541	-0.048	-0.254	0.057	0.1537	0.1879	-0.119	-0.0798	0.0814	0.0156	-0.0326	-0.0139	0.0199	0.0391	27.4927	25.8889	-2.3355
28	0.0805	-0.0006	0.0287	0.0616	-0.0238	0.02	-0.0267	-0.0234	0.0107	0.0663	0.0778	-0.0288	-0.0179	-0.0014	-0.0323	0.1045	0.0676	-0.0103	0.1265	-0.0461	0.0721	32.6939	15.1092	17.8256
29	0.0403	0.0127	0.074	0.3915	-0.2468	0.3174	-0.0302	-0.0417	-0.0153	-0.0416	0.0819	-0.0086	0.0489	-0.0892	-0.034	0.0729	0.0072	0.0227	0.0834	0.0222	0.0609	33.7997	3.2034	18.7747
30	0.1463	0.0437	0.0915	0.0366	0.04	0.0632	0.1095	0.0295	-0.0092	-0.1875	-0.0582	-0.0762	0.1344	-0.0047	-0.0605	0.1675	0.0345	0.0595	-0.0511	0.0391	0.0498	41.0934	6.5425	2.4276
31	0.1772	0.1352	0.0623	0.2372	-0.0947	0.1802	0.0047	0.0032	0.1207	-0.0687	-0.0868	-0.0944	-0.0044	-0.0261	0.0668	0.0353	-0.0011	-0.0004	0.0197	0.0052	0.1047	38.3196	15.869	7.6662
32	0.2089	-0.1298	0.15	0.2291	-0.0503	0.1222	0.0149	0.033	0.1528	-0.0983	-0.1257	-0.0529	0.0551	-0.0342	0.0573	0.0786	-0.0117	-0.0111	-0.009	0.0039	0.0745	35.8219	14.6131	2.5585
33	0.042	0.0131	-0.02	0.0066	-0.0078	0.0097	-0.0155	0.0008	-0.0021	0.0281	-0.0842	-0.0699	0.0077	0.0564	0.0722	0.2868	0.0054	0.0815	0.2089	0.1301	0.2995	48.316	21.4772	-9.6148
34	0.0135	0.0264	0.0238	0.1122	-0.0409	0.1464	-0.0908	0.0361	0.0768	0.0069	-0.0949	-0.1056	-0.0519	0.0764	0.1567	0.0484	-0.0329	-0.1031	0.0589	0.1066	0.4377	52.8151	21.3423	7.4576
35	0.1061	-0.1486	0.0929	0.4967	-0.1727	0.2804	-0.0227	0.0809	0.3819	-0.0329	-0.2148	-0.5333	0.0768	0.1493	0.2112	0.0389	0.0559	0.0962	0.0679	0.2089	0.2904	52.5531	14.548	0.8484
36	0.0467	0.044	0.0062	0.0565	-0.0839	0.4561	-0.0974	-0.0271	0.0373	0.1557	-0.17	-0.1753	-0.211	0.0903	0.2278	0.1388	-0.0088	-0.169	0.0807	0.0334	0.288	54.5102	11.4779	21.1262
37	0.0025	0.005	0.005	0.0241	0.0135	0.0108	-0.0177	0.0077	0.0347	-0.0016	-0.0251	0.0068	-0.0098	0.0235	0.0319	0.4283	0.063	-0.2397	0.4639	-0.0322	0.5425	57.2317	8.2489	28.5411
38	0.1705	-0.2549	-0.0579	0.4182	0.0142	0.3274	-0.0241	0.0198	0.1489	0.0555	-0.1446	-0.2808	0.0877	0.1317	0.1459	0.1072	0.0398	0.005	0.1101	0.0633	0.1715	51.1549	2.7648	18.0722
39	0.1382	-0.0625	0.0175	0.0759	0.0697	0.1195	-0.0565	0.0302	0.0582	0.0614	-0.0519	-0.0697	0.1802	0.0709	0.0687	0.1727	0.1182	0.0896	-0.0287	0.0746	0.1778	50.334	1.8405	6.0091
40	0.0409	0.0375	-0.0048	0.0368	-0.0012	0.0201	-0.0378	0.0152	0.0616	0.0213	-0.042	-0.1035	-0.035	-0.0058	0.0615	0.3122	0.0583	-0.1803	0.1394	-0.0051	0.3585	32.251	-16.0741	14.3677

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details	Auth asym-ID	Auth seq-ID
1	X-RAY DIFFRACTION	1	(CHAIN A AND RESID 151:157)	A	151 - 157
2	X-RAY DIFFRACTION	2	(CHAIN A AND RESID 158:166)	A	158 - 166
3	X-RAY DIFFRACTION	3	(CHAIN A AND RESID 167:179)	A	167 - 179
4	X-RAY DIFFRACTION	4	(CHAIN A AND RESID 180:198)	A	180 - 198
5	X-RAY DIFFRACTION	5	(CHAIN A AND RESID 199:206)	A	199 - 206
6	X-RAY DIFFRACTION	6	(CHAIN A AND RESID 207:216)	A	207 - 216
7	X-RAY DIFFRACTION	7	(CHAIN A AND RESID 217:242)	A	217 - 242
8	X-RAY DIFFRACTION	8	(CHAIN A AND RESID 243:249)	A	243 - 249
9	X-RAY DIFFRACTION	9	(CHAIN A AND RESID 250:258)	A	250 - 258
10	X-RAY DIFFRACTION	10	(CHAIN A AND RESID 259:267)	A	259 - 267
11	X-RAY DIFFRACTION	11	(CHAIN A AND RESID 268:291)	A	268 - 291
12	X-RAY DIFFRACTION	12	(CHAIN A AND RESID 292:311)	A	292 - 311
13	X-RAY DIFFRACTION	13	(CHAIN A AND RESID 312:338)	A	312 - 338
14	X-RAY DIFFRACTION	14	(CHAIN A AND RESID 339:359)	A	339 - 359
15	X-RAY DIFFRACTION	15	(CHAIN A AND RESID 360:386)	A	360 - 386
16	X-RAY DIFFRACTION	16	(CHAIN A AND RESID 387:395)	A	387 - 395
17	X-RAY DIFFRACTION	17	(CHAIN A AND RESID 396:440)	A	396 - 440
18	X-RAY DIFFRACTION	18	(CHAIN A AND RESID 441:471)	A	441 - 471
19	X-RAY DIFFRACTION	19	(CHAIN A AND RESID 472:491)	A	472 - 491
20	X-RAY DIFFRACTION	20	(CHAIN A AND RESID 492:496)	A	492 - 496
21	X-RAY DIFFRACTION	21	(CHAIN B AND RESID 151:166)	B	151 - 166
22	X-RAY DIFFRACTION	22	(CHAIN B AND RESID 167:172)	B	167 - 172
23	X-RAY DIFFRACTION	23	(CHAIN B AND RESID 173:180)	B	173 - 180
24	X-RAY DIFFRACTION	24	(CHAIN B AND RESID 181:198)	B	181 - 198
25	X-RAY DIFFRACTION	25	(CHAIN B AND RESID 199:208)	B	199 - 208
26	X-RAY DIFFRACTION	26	(CHAIN B AND RESID 209:218)	B	209 - 218
27	X-RAY DIFFRACTION	27	(CHAIN B AND RESID 219:265)	B	219 - 265
28	X-RAY DIFFRACTION	28	(CHAIN B AND RESID 266:275)	B	266 - 275
29	X-RAY DIFFRACTION	29	(CHAIN B AND RESID 276:295)	B	276 - 295
30	X-RAY DIFFRACTION	30	(CHAIN B AND RESID 296:314)	B	296 - 314
31	X-RAY DIFFRACTION	31	(CHAIN B AND RESID 315:328)	B	315 - 328
32	X-RAY DIFFRACTION	32	(CHAIN B AND RESID 329:345)	B	329 - 345
33	X-RAY DIFFRACTION	33	(CHAIN B AND RESID 346:356)	B	346 - 356
34	X-RAY DIFFRACTION	34	(CHAIN B AND RESID 357:374)	B	357 - 374
35	X-RAY DIFFRACTION	35	(CHAIN B AND RESID 375:413)	B	375 - 413
36	X-RAY DIFFRACTION	36	(CHAIN B AND RESID 414:440)	B	414 - 440
37	X-RAY DIFFRACTION	37	(CHAIN B AND RESID 441:446)	B	441 - 446
38	X-RAY DIFFRACTION	38	(CHAIN B AND RESID 447:471)	B	447 - 471
39	X-RAY DIFFRACTION	39	(CHAIN B AND RESID 472:491)	B	472 - 491
40	X-RAY DIFFRACTION	40	(CHAIN B AND RESID 492:500)	B	492 - 500

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