PDB-3foz: Structure of E. coli Isopentenyl-tRNA transferase in complex with...

ID or keywords:

Entry

Database: PDB / ID: 3foz

Title

Structure of E. coli Isopentenyl-tRNA transferase in complex with E. coli tRNA(Phe)

Components

(tRNA(Phe)) x 2
tRNA delta(2)-isopentenylpyrophosphate transferase

Keywords

TRANSFERASE/RNA / tRNA / nucleoside modification / isopentenyl-tRNA transferase / MiaA / TRANSFERASE-RNA COMPLEX

Function / homology

Function and homology information

regulation of cytoplasmic translation in response to stress / tRNA dimethylallyltransferase / tRNA dimethylallyltransferase activity / tRNA modification / cellular response to heat / ATP binding
Similarity search - Function

Biological species

Escherichia coli K-12 (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 2.5 Å

Authors

Seif, E. / Hallberg, B.M.

Citation

Journal: J.Biol.Chem. / Year: 2009
Title: RNA-Protein Mutually Induced Fit: STRUCTURE OF ESCHERICHIA COLI ISOPENTENYL-tRNA TRANSFERASE IN COMPLEX WITH tRNA(Phe).
Authors: Seif, E. / Hallberg, B.M.

History

Deposition	Jan 2, 2009	Deposition site: RCSB / Processing site: PDBJ
Revision 1.0	Jan 20, 2009	Provider: repository / Type: Initial release
Revision 1.1	Jul 13, 2011	Group: Advisory / Version format compliance
Revision 1.2	May 23, 2018	Group: Data collection / Category: diffrn_source / Item: _diffrn_source.pdbx_synchrotron_site
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 / pdbx_struct_conn_angle / struct_conn / 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_comp_id / _pdbx_struct_conn_angle.ptnr1_auth_seq_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_seq_id / _pdbx_struct_conn_angle.ptnr2_label_asym_id / _pdbx_struct_conn_angle.ptnr3_auth_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_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_conn.ptnr2_label_seq_id / _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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Download

PDBx/mmCIF format	3foz.cif.gz	216.1 KB	Display	PDBx/mmCIF format
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Validation report

Summary document	3foz_validation.pdf.gz	470.2 KB	Display	wwPDB validaton report
Full document	3foz_full_validation.pdf.gz	478 KB	Display
Data in XML	3foz_validation.xml.gz	26.7 KB	Display
Data in CIF	3foz_validation.cif.gz	38.6 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/fo/3foz ftp://data.pdbj.org/pub/pdb/validation_reports/fo/3foz	HTTPS FTP

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Related structure data

Related structure data	1tttS 3d3qS S: Starting model for refinement
Similar structure data	2zxu-d 2zm5-d 7k5j-8 6zsl-d 5rmk-d 5rlw-d 7k5j-7 5rlq-d 5rlt-d 1ukl-1 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	#121 - Jan 2010 70S Ribosomes similarity (1) #130 - Oct 2010 Riboswitches similarity (1) #16 - Apr 2001 Aminoacyl-tRNA Synthetases similarity (1) #157 - Jan 2013 Transfer-Messenger RNA similarity (1) #181 - Jan 2015 Cascade and CRISPR similarity (1) #229 - Jan 2019 Fluorescent RNA Aptamers similarity (1) #253 - Jan 2021 Expressome similarity (1) #260 - Aug 2021 Ribonuclease P similarity (1) #146 - Feb 2012 Aminoglycoside Antibiotics similarity (1) #15 - Mar 2001 Transfer RNA similarity (1) #249 - Sep 2020 SARS-CoV-2 RNA-dependent RNA Polymerase similarity (1) #10 - Oct 2000 Ribosome similarity (1) #210 - Jun 2017 Adenine Riboswitch in Action similarity (1) #87 - Mar 2007 Zinc Fingers similarity (1) #105 - Sep 2008 Ribonuclease A similarity (1) #226 - Oct 2018 Aminoglycoside Antibiotics and Resistance similarity (1) #245 - May 2020 Spliceosomes similarity (1) #262 - Oct 2021 Fifty Years of Open Access to PDB Structures similarity (1) #65 - May 2005 Self-splicing RNA similarity (1) #98 - Feb 2008 Small Interfering RNA similarity (1) #104 - Aug 2008 Selenocysteine Synthase similarity (1) #106 - Oct 2008 Poly(A) Polymerase similarity (1) #143 - Nov 2011 Toll-like Receptors similarity (1) #161 - May 2013 Ricin similarity (1) #227 - Nov 2018 Telomerase similarity (1) #230 - Feb 2019 Initiation Factor eIF4E similarity (1) #266 - Feb 2022 Oligosaccharyltransferase similarity (1) #81 - Sep 2006 Elongation Factors similarity (1) #89 - May 2007 Aconitase and Iron Regulatory Protein 1 similarity (1) #241 - Jan 2020 Twenty Years of Molecules similarity (1)

PDB pages

PDBj /

wwPDB /

NCBI

Related items in Molecule of the Month

#121 - Jan 2010
70S Ribosomes
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Deposited unit

A: tRNA delta(2)-isopentenylpyrophosphate transferase

B: tRNA delta(2)-isopentenylpyrophosphate transferase

C: tRNA(Phe)

D: tRNA(Phe)

hetero molecules

117 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

Idetical with deposited unit
defined by author&software

Unit cell

Length a, b, c (Å)	89.240, 91.260, 152.360
Angle α, β, γ (deg.)	90.00, 90.00, 90.00
Int Tables number	19
Space group name H-M	P2₁2₁2₁

#1: Protein	tRNA delta(2)-isopentenylpyrophosphate transferase / MiaA / IPP transferase / Isopentenyl-diphosphate:tRNA isopentenyltransferase / IPTase / IPPT Mass: 35107.094 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli K-12 (bacteria) / Strain: K12 / Gene: b4171, E. coli, JW4129, miaA, trpX / Plasmid: pNIC-BSA4 (GI: EF198106) / Production host: Escherichia coli (E. coli) / Strain (production host): KRX / References: UniProt: P16384, EC: 2.5.1.8
#2: RNA chain	tRNA(Phe) Mass: 23852.137 Da / Num. of mol.: 1 / Source method: obtained synthetically Details: TRNA WAS PREPARED BY IN-VITRO TRANSCRIPTION WITH T7
#3: RNA chain	tRNA(Phe) Mass: 22261.195 Da / Num. of mol.: 1 / Source method: obtained synthetically Details: TRNA WAS PREPARED BY IN-VITRO TRANSCRIPTION WITH T7
#4: Chemical	... ChemComp-CA / CALCIUM ION Mass: 40.078 Da / Num. of mol.: 22 / Source method: obtained synthetically / Formula: Ca
#5: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 73 / 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: 2.67 Å³/Da / Density % sol: 53.87 %

Crystal grow

Temperature: 293 K / Method: vapor diffusion, hanging drop / pH: 6.5
Details: PEG 4K 15%, 0.2M CaCl2, pH 6.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

Components of the solutions

ID	Name	Crystal-ID	Sol-ID
1	PEG 4000	1	1
2	CaCl2	1	1
3	PEG 4000	1	2
4	CaCl2	1	2

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: MAX II / Beamline: I911-3 / Wavelength: 0.97 Å
Detector	Type: MARMOSAIC 325 mm CCD / Detector: CCD / Date: Oct 11, 2008 / Details: Double crystal monochromator, Si(111)
Radiation	Monochromator: Double crystal monochromator, Si(111) / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.97 Å / Relative weight: 1
Reflection	Resolution: 2.5→78.29 Å / Num. all: 43836 / Num. obs: 43749 / % possible obs: 99.8 % / Observed criterion σ(F): -3 / Observed criterion σ(I): -3 / Redundancy: 6.5 % / B_iso Wilson estimate: 51 Å² / R_sym value: 0.097 / Net I/σ(I): 6.8
Reflection shell	Resolution: 2.5→2.6 Å / Mean I/σ(I) obs: 2.14 / R_sym value: 0.493 / % possible all: 100

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Processing

Software

Name	Version	Classification
MxCuBE		data collection
PHASER		phasing
REFMAC	5.5.0044	refinement
MOSFLM		data reduction
SCALA		data scaling

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: 3D3Q, 1TTT

3d3q

1ttt

Resolution: 2.5→30 Å / Cor.coef. F_o:F_c: 0.898 / Cor.coef. F_o:F_c free: 0.837 / SU B: 23.52 / SU ML: 0.239 / TLS residual ADP flag: LIKELY RESIDUAL / Cross valid method: THROUGHOUT / σ(F): -3 / ESU R: 0.576 / ESU R Free: 0.33 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.26822	2133	5 %	RANDOM
R_work	0.24389	-	-	-
all	0.24517	43779	-	-
obs	0.24517	40403	97.16 %	-

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: 22.657 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	0.3 Å²	0 Å²	-0 Å²
2-	-	1.46 Å²	0 Å²
3-	-	-	-1.76 Å²

Refinement step

Cycle: LAST / Resolution: 2.5→30 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	4783	3055	22	73	7933

Refine LS restraints

Refine-ID	Type	Dev ideal	Dev ideal target	Number
X-RAY DIFFRACTION	r_bond_refined_d	0.008	0.021	8298
X-RAY DIFFRACTION	r_bond_other_d	0.001	0.02	4557
X-RAY DIFFRACTION	r_angle_refined_deg	1.279	2.428	11945
X-RAY DIFFRACTION	r_angle_other_deg	0.875	3	11262
X-RAY DIFFRACTION	r_dihedral_angle_1_deg	5.849	5	606
X-RAY DIFFRACTION	r_dihedral_angle_2_deg	34.731	23.158	228
X-RAY DIFFRACTION	r_dihedral_angle_3_deg	16.788	15	833
X-RAY DIFFRACTION	r_dihedral_angle_4_deg	17.201	15	48
X-RAY DIFFRACTION	r_chiral_restr	0.059	0.2	1451
X-RAY DIFFRACTION	r_gen_planes_refined	0.004	0.021	6928
X-RAY DIFFRACTION	r_gen_planes_other	0.001	0.02	1319
X-RAY DIFFRACTION	r_mcbond_it	4.415	2	3036
X-RAY DIFFRACTION	r_mcbond_other	1.369	2	1216
X-RAY DIFFRACTION	r_mcangle_it	6.154	3	4866
X-RAY DIFFRACTION	r_scbond_it	4.344	2	5262
X-RAY DIFFRACTION	r_scangle_it	5.707	3	7079

LS refinement shell

Resolution: 2.5→2.565 Å / Total num. of bins used: 20

	R_factor	Num. reflection	% reflection
R_free	0.414	139	-
R_work	0.382	2949	-
obs	-	-	97.35 %

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	4.3816	0.4678	1.6979	1.6334	2.0721	5.4818	-0.1484	0.1945	0.3292	-0.1984	-0.0029	0.2039	-0.308	-0.0887	0.1514	0.1684	0.0115	0.0164	0.0396	0.0866	0.236	4.317	34.95	-22.108
2	0.337	0.207	-0.1796	1.1209	0.3221	1.9331	0.1323	0.0262	-0.0087	-0.0571	-0.0782	0.2593	0.0808	-0.2118	-0.0542	0.1096	0.0201	-0.0206	0.1109	0.0091	0.2708	0.755	25.488	-13.288
3	1.4328	-1.2255	0.6865	2.042	-1.0168	2.5529	0.0598	0.0571	0.0019	-0.2217	-0.0032	-0.1439	0.0304	-0.0572	-0.0565	0.0525	-0.0305	-0.0054	0.0913	0.0051	0.2462	11.763	19.329	-15.917
4	2.2367	0.3153	0.6726	0.8206	0.5542	9.1326	-0.0097	-0.2242	-0.1579	0.1241	-0.042	-0.1178	0.3775	0.3361	0.0516	0.0791	0.0087	-0.0176	0.0769	0.0335	0.2942	29.803	7.503	-0.315
5	0.7816	-0.448	-0.0704	1.1861	-0.4654	0.3766	0.0087	0.0686	-0.0869	-0.1558	0.0377	0.0008	0.0212	0.0237	-0.0464	0.1482	-0.0058	0.016	0.1284	-0.0265	0.2677	21.722	15.5	-15.415
6	8.4726	-0.1887	-8.6086	2.2772	-1.9204	10.7195	0.2476	0.416	0.2252	0.0022	-0.0976	-0.0704	-0.3065	-0.3465	-0.15	0.2575	-0.0046	-0.0678	0.1108	-0.0171	0.2832	13.567	44.227	-5.037
7	2.7433	-2.6129	1.0626	3.606	-0.3645	3.0742	-0.0578	-0.2979	-0.0932	0.3523	0.0967	-0.0126	0.0697	-0.0901	-0.0388	0.1088	-0.0177	0.01	0.132	0.0056	0.2587	5.627	26.351	6.342
8	1.5131	0.4688	-0.1872	3.7849	-1.7291	9.6061	-0.1428	-0.0088	-0.0279	0.0684	-0.0198	-0.1319	0.1502	-0.0501	0.1626	0.1056	0.0276	0.0211	0.1109	-0.02	0.2024	11.873	30.055	8.856
9	1.4072	-1.3796	-3.4227	1.9874	2.1444	10.8167	-0.0368	-0.1727	0.1266	0.1977	0.1939	-0.145	-0.0682	0.3642	-0.1572	0.1981	-0.0135	0.0184	0.1039	-0.03	0.2325	17.121	37.372	2.887
10	4.4632	-1.3344	1.5399	1.4024	1.1715	5.109	0.0966	0.1683	0.6088	-0.3984	-0.0643	-0.2229	-0.4819	0.0745	-0.0323	0.2242	-0.0272	0.0385	0.0452	0.0698	0.2699	13.049	39.484	-21.737
11	1.5997	-0.3751	-0.2903	2.0299	-1.3396	7.6858	-0.1554	0.0151	-0.2394	-0.1944	0.1197	-0.2478	0.4198	0.4482	0.0357	0.1843	0.0416	0.0061	0.0667	-0.0287	0.3138	22.784	27.862	41.373
12	2.2767	0.7082	1.0904	0.331	0.6678	1.6935	0.0265	-0.1264	-0.3904	0.1887	0.0278	-0.1015	0.6104	0.0289	-0.0543	0.3366	0.0604	-0.0108	0.1131	0.0288	0.2716	9.524	24.381	43.634
13	4.7002	-0.3039	0.4738	1.8996	-0.6424	4.3738	0.145	0.1561	-0.028	0.2163	-0.2718	-0.2672	0.1479	0.3976	0.1268	0.1718	0.0296	-0.0153	0.0789	0.0224	0.2155	17.55	30.86	47.54
14	4.4521	-2.0596	1.1882	4.0308	-0.5034	3.0946	0.3077	0.033	0.1541	0.394	-0.1622	0.4942	-0.3585	-0.4583	-0.1456	0.2479	0.0763	0.1448	0.0983	-0.0118	0.2459	-7.282	45.728	52.103
15	2.1364	0.3314	-1.1985	2.4199	0.5849	4.5468	0.167	-0.1148	0.1777	0.3287	-0.0448	0.0469	-0.3087	-0.1508	-0.1222	0.2708	0.0459	0.0676	0.0312	-0.0303	0.2655	-1.59	48.039	55.156
16	1.0313	-0.8672	-0.4985	2.9249	-4.2042	10.4994	-0.0566	-0.2942	-0.0506	0.2021	0.2309	-0.0506	-0.2831	0.2284	-0.1744	0.1273	0.0191	-0.0498	0.1596	-0.0221	0.3157	23.279	35.516	47.79
17	6.6192	7.0963	5.7391	9.4361	6.027	5.1669	-0.0477	0.3292	-0.2786	-0.0777	0.1841	-0.5042	-0.0451	0.3674	-0.1365	0.1346	0.0154	0.0271	0.1252	-0.0101	0.2091	15.538	38.243	24.163
18	5.8115	-0.9577	-4.9398	1.9067	1.2275	9.0302	-0.0431	0.2161	-0.0494	-0.0649	-0.1263	0.3088	0.3422	-0.4483	0.1693	0.1728	-0.0324	-0.0106	0.0417	-0.0105	0.2363	-2.356	25.546	28.649
19	2.232	0.7996	1.0959	0.4333	0.729	1.6689	0.0325	0.1489	0.2441	0.0728	-0.0109	0.1063	-0.0381	-0.09	-0.0217	0.1923	-0.0028	0.0102	0.0499	0.0036	0.2904	2.061	37.558	29.753
20	7.369	-3.1185	-0.6654	6.7818	-0.3442	5.6992	0.1101	-0.1388	0.1197	-0.3334	0.0247	-0.8721	-0.073	0.8928	-0.1349	0.0591	-0.017	-0.0393	0.1408	-0.0279	0.324	29.333	36.154	38.341
21	4.0546	-2.8087	-3.8757	5.3733	0.3878	8.9117	-0.1532	0.7707	0.5774	0.3024	-0.4895	-0.7998	-0.296	0.3484	0.6427	0.1576	-0.1401	-0.0859	0.6104	0.239	0.5391	33.025	55.712	36.508
22	4.5534	-1.8729	0.5514	1.9778	0.4074	0.4181	-0.1034	-0.4512	-0.2647	0.1037	0.1305	0.0643	-0.011	-0.1398	-0.027	0.179	0.0537	0.062	0.2629	-0.0358	0.2625	36.093	47.935	21.95
23	7.7774	0.5301	1.3366	3.791	-0.3154	0.2838	-0.0099	0.0782	-0.1937	0.1021	0.0712	0.364	-0.0325	-0.0321	-0.0612	0.1162	0.0325	0.041	0.1831	-0.0398	0.234	34.677	41.756	11.797
24	7.6533	-1.6102	-0.8827	0.3999	0.7753	5.9088	-0.0587	0.1003	0.2988	0.0239	0.009	-0.0562	0.0621	0.1474	0.0496	0.117	0.0314	-0.0052	0.1502	-0.0088	0.2644	53.484	42.305	16.081
25	0.92	1.0209	0.7053	1.2919	1.0896	1.3102	0.067	-0.024	-0.1502	-0.0168	0.0585	-0.2156	-0.0718	0.1162	-0.1256	0.121	0.0067	0.0193	0.144	-0.0288	0.2953	29.739	31.929	-3.263
26	1.5857	0.0001	-0.2376	0.7262	0.4715	1.2409	-0.0373	-0.1745	0.0487	0.0471	-0.0316	-0.124	0.0191	-0.0023	0.0689	0.1066	0.0136	0.0187	0.0778	0.0213	0.2868	23.853	25.494	-5.215
27	5.6779	7.3244	3.7485	9.6104	5.7067	8.5523	-0.916	0.3855	0.4355	-1.248	0.3261	0.719	-1.2036	-0.4937	0.5899	0.3889	0.0419	-0.1076	0.3535	-0.1274	0.5106	39.428	46.09	2.641
28	0.3869	0.1097	-0.4333	0.693	0.5412	2.1158	0.0136	-0.0618	0.3093	0.0341	0.1224	0.0043	-0.2415	0.2029	-0.136	0.18	-0.0079	-0.0129	0.0811	-0.068	0.3801	51.666	52.861	18.85
29	0.7151	0.8259	-0.9591	1.1306	-0.8281	1.8367	-0.0021	0.1141	0.174	-0.0173	0.204	0.2004	-0.1432	-0.1521	-0.202	0.2115	0.0394	0.0217	0.2574	-0.0589	0.4092	36.772	55.532	26.253
30	0.7561	1.6281	1.149	3.514	2.174	12.9643	0.0583	-0.133	0.354	0.1525	-0.2694	0.7683	-0.7819	-0.8726	0.211	0.1527	0.0067	-0.0136	0.2147	-0.0325	0.2324	24.389	54.151	40.51
31	0.4919	0.7943	-1.9124	1.5974	-3.8943	9.5238	0.0571	0.0809	0.1058	-0.3668	0.0996	0.1003	0.9024	-0.1794	-0.1566	0.8541	0.0917	-0.206	0.2813	-0.0782	0.5608	-6.476	60.242	0.337
32	3.4099	-1.0718	0.5272	9.3858	-2.6952	1.3533	0.082	0.1932	-0.1548	-0.1302	-0.1554	0.1959	0.1842	-0.1243	0.0733	0.293	0.0607	-0.024	0.1305	-0.0222	0.1902	0.126	59.772	14.494
33	1.1195	3.2074	-0.2017	9.5767	0.661	4.8864	0.0468	-0.1292	-0.0715	-0.0203	-0.4166	-0.1827	-0.0552	0.099	0.3697	0.3585	0.1263	0.0656	0.1545	0.076	0.1553	1.303	78.27	12.741
34	0.1266	-0.3975	0.5197	1.6933	-2.0054	2.4664	-0.0776	0.0689	0.0358	0.3916	0.0373	0.0776	-0.5096	0.0647	0.0402	0.3585	0.0274	-0.0529	0.2022	0.0618	0.3441	5.053	55.609	26.156
35	0.5232	0.1335	-0.6245	2.576	-1.8643	2.1867	0.1214	0.0198	0.0849	0.2198	-0.0666	0.3215	-0.3238	0.0146	-0.0548	0.2117	0.0233	0.0035	0.0537	-0.0131	0.2655	3.898	45.958	41.977
36	7.0772	6.67	4.7117	6.295	4.4483	3.1455	1.3958	0.7474	-2.4586	1.4737	0.4744	-2.3968	1.0025	0.4063	-1.8703	1.3353	0.3724	-0.344	1.0471	0.6605	1.7288	9.778	61.893	18.131
37	1.7585	0.4628	0.596	0.129	0.1604	0.2113	-0.0675	0.7595	-0.2907	-0.0709	0.1688	-0.1104	-0.1041	0.243	-0.1013	0.7998	0.1952	0.1609	0.4621	0.0217	0.2322	6.001	72.904	-0.185
38	2.1357	0.9748	0.2032	9.2794	0.1142	2.0064	0.0347	0.3702	-0.0483	-0.2797	-0.015	-0.188	-0.1699	0.0551	-0.0198	0.2784	0.0532	0.0158	0.1799	0.0247	0.1688	3.268	77.524	6.429
39	0.0691	-0.2938	0	9.1213	0	11.2501	0.2297	0.1567	0.0463	-1.2817	-0.5565	-0.2893	1.2034	0.4609	0.3267	0.9214	0.3893	0.144	0.5471	-0.0329	0.281	0.868	67.46	-6.307
40	3.2348	0.9895	3.2892	0.3698	0.6298	6.9283	0.4452	-0.6092	-1.1009	0.0503	-0.3409	-0.3357	0.7838	0.0737	-0.1044	0.6571	-0.0283	-0.2628	0.5525	0.083	1.0815	-8.427	52.69	-5.033

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Auth asym-ID	Auth seq-ID
1	X-RAY DIFFRACTION	1	A	7 - 33
2	X-RAY DIFFRACTION	2	A	34 - 99
3	X-RAY DIFFRACTION	3	A	100 - 131
4	X-RAY DIFFRACTION	4	A	132 - 153
5	X-RAY DIFFRACTION	5	A	154 - 204
6	X-RAY DIFFRACTION	6	A	205 - 221
7	X-RAY DIFFRACTION	7	A	222 - 247
8	X-RAY DIFFRACTION	8	A	248 - 263
9	X-RAY DIFFRACTION	9	A	264 - 280
10	X-RAY DIFFRACTION	10	A	281 - 311
11	X-RAY DIFFRACTION	11	B	10 - 42
12	X-RAY DIFFRACTION	12	B	43 - 96
13	X-RAY DIFFRACTION	13	B	97 - 114
14	X-RAY DIFFRACTION	14	B	115 - 153
15	X-RAY DIFFRACTION	15	B	154 - 191
16	X-RAY DIFFRACTION	16	B	192 - 204
17	X-RAY DIFFRACTION	17	B	205 - 219
18	X-RAY DIFFRACTION	18	B	220 - 241
19	X-RAY DIFFRACTION	19	B	242 - 287
20	X-RAY DIFFRACTION	20	B	288 - 311
21	X-RAY DIFFRACTION	21	C	1 - 4
22	X-RAY DIFFRACTION	22	C	5 - 8
23	X-RAY DIFFRACTION	23	C	9 - 15
24	X-RAY DIFFRACTION	24	C	16 - 20
25	X-RAY DIFFRACTION	25	C	21 - 34
26	X-RAY DIFFRACTION	26	C	35 - 43
27	X-RAY DIFFRACTION	27	C	44 - 47
28	X-RAY DIFFRACTION	28	C	48 - 61
29	X-RAY DIFFRACTION	29	C	62 - 70
30	X-RAY DIFFRACTION	30	C	71 - 74
31	X-RAY DIFFRACTION	31	D	4 - 7
32	X-RAY DIFFRACTION	32	D	8 - 16
33	X-RAY DIFFRACTION	33	D	17 - 20
34	X-RAY DIFFRACTION	34	D	21 - 30
35	X-RAY DIFFRACTION	35	D	31 - 43
36	X-RAY DIFFRACTION	36	D	44 - 47
37	X-RAY DIFFRACTION	37	D	48 - 55
38	X-RAY DIFFRACTION	38	D	56 - 61
39	X-RAY DIFFRACTION	39	D	62 - 66
40	X-RAY DIFFRACTION	40	D	67 - 72

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