PDB-4xr7: Structure of the Saccharomyces cerevisiae PAN2-PAN3 core complex

ID or keywords:

Entry

Database: PDB / ID: 4xr7

Title

Structure of the Saccharomyces cerevisiae PAN2-PAN3 core complex

Components

PAB-dependent poly(A)-specific ribonuclease subunit PAN2
PAB-dependent poly(A)-specific ribonuclease subunit PAN3

Keywords

HYDROLASE / RNA degradation /

Deadenylation /

Pseudokinase

Function / homology

Function and homology information

PAN complex /

poly(A)-specific ribonuclease /

poly(A)-specific ribonuclease activity / nuclear-transcribed mRNA poly(A) tail shortening /

poly(A) binding /

postreplication repair /

P-body /

mRNA processing /

nucleic acid binding /

protein kinase activity ...
Similarity search - Function

Biological species

Saccharomyces cerevisiae (brewer's yeast)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

SAD / Resolution: 3.796 Å

Authors

Schafer, I.B. / Rode, M. / Bonneau, F. / Schussler, S. / Conti, E.

Funding support

Germany, 6items

Citation

Journal: Nat. Struct. Mol. Biol. / Year: 2014
Title: The structure of the Pan2-Pan3 core complex reveals cross-talk between deadenylase and pseudokinase.
Authors: Schafer, I.B. / Rode, M. / Bonneau, F. / Schussler, S. / Conti, E.

History

Deposition	Jan 20, 2015	Deposition site: RCSB / Processing site: PDBE
Supersession	Jan 28, 2015	ID: 4Q8J Details: D_1000206167 is an updated version of 4Q8J that resolves some issues of the original deposited structure such as cis-peptides and other discrepancies between NCS related chains.
Revision 1.0	Jan 28, 2015	Provider: repository / Type: Initial release

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	4xr7.cif.gz	2.3 MB	Display	PDBx/mmCIF format
PDB format	pdb4xr7.ent.gz	2 MB	Display	PDB format
PDBx/mmJSON format	4xr7.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/xr/4xr7 ftp://data.pdbj.org/pub/pdb/validation_reports/xr/4xr7	HTTPS FTP

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Related structure data

Related structure data	4q8gC 4q8hC C: citing same article (ref.)
Similar structure data	1kmm-d 1kmn-d 4h2p-d 1dce-d 4h2n-1 4gf7-1 4lcm-d 4h2r-1 6d7k-d 5uja-d 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 - FunctionF&H Search Similarity search - HomologyF&H Search

Related structure data

4q8gC

4q8hC

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	#86 - Feb 2007 Exosomes similarity (1) #245 - May 2020 Spliceosomes similarity (2)

Deposited unit

G: PAB-dependent poly(A)-specific ribonuclease subunit PAN2

L: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

K: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

E: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

F: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

D: PAB-dependent poly(A)-specific ribonuclease subunit PAN2

H: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

I: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

J: PAB-dependent poly(A)-specific ribonuclease subunit PAN2

C: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

B: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

A: PAB-dependent poly(A)-specific ribonuclease subunit PAN2

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

1

G: PAB-dependent poly(A)-specific ribonuclease subunit PAN2

H: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

I: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

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

2

L: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

K: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

J: PAB-dependent poly(A)-specific ribonuclease subunit PAN2

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

3

E: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

F: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

D: PAB-dependent poly(A)-specific ribonuclease subunit PAN2

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

4

C: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

B: PAB-dependent poly(A)-specific ribonuclease subunit PAN3

A: PAB-dependent poly(A)-specific ribonuclease subunit PAN2

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

Unit cell

Length a, b, c (Å)	131.443, 205.298, 234.410
Angle α, β, γ (deg.)	90.00, 94.10, 90.00
Int Tables number	4
Space group name H-M	P12₁1

#1: Protein	PAB-dependent poly(A)-specific ribonuclease subunit PAN2 / PAB1P-dependent poly(A)-nuclease / PAN deadenylation complex catalytic subunit 2 Mass: 89263.133 Da / Num. of mol.: 4 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Saccharomyces cerevisiae (brewer's yeast) Gene: PAN2, YGL094C / Production host: Trichoplusia ni (cabbage looper) / References: UniProt: P53010, poly(A)-specific ribonuclease
#2: Protein	PAB-dependent poly(A)-specific ribonuclease subunit PAN3 / PAB1P-dependent poly(A)-nuclease / PAN deadenylation complex subunit 3 Mass: 54330.719 Da / Num. of mol.: 8 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Saccharomyces cerevisiae (brewer's yeast) Gene: PAN3, ECM35, YKL025C / Production host: Trichoplusia ni (cabbage looper) / References: UniProt: P36102

#1: Protein

PAB-dependent poly(A)-specific ribonuclease subunit PAN2 / PAB1P-dependent poly(A)-nuclease / PAN deadenylation complex catalytic subunit 2

Mass: 89263.133 Da / Num. of mol.: 4
Source method: isolated from a genetically manipulated source
Source: (gene. exp.)

Saccharomyces cerevisiae (brewer's yeast)
Gene: PAN2, YGL094C / Production host:

Trichoplusia ni (cabbage looper) / References: UniProt: P53010,

poly(A)-specific ribonuclease

#2: Protein

PAB-dependent poly(A)-specific ribonuclease subunit PAN3 / PAB1P-dependent poly(A)-nuclease / PAN deadenylation complex subunit 3

Mass: 54330.719 Da / Num. of mol.: 8
Source method: isolated from a genetically manipulated source
Source: (gene. exp.)

Saccharomyces cerevisiae (brewer's yeast)
Gene: PAN3, ECM35, YKL025C / Production host:

Trichoplusia ni (cabbage looper) / References: UniProt: P36102

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Experiment

Experiment	Method: X-RAY DIFFRACTION

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Sample preparation

Crystal	Density Matthews: 3.98 Å³/Da / Density % sol: 69.13 %
Crystal grow	Temperature: 293 K / Method: vapor diffusion, sitting drop / Details: 0.1 M CHES, pH 9.2, 29% v/v PEG400

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: SLS / Beamline: X10SA / Wavelength: 0.97974 Å
Detector	Type: PSI PILATUS 6M / Detector: PIXEL / Date: Aug 26, 2013
Radiation	Monochromator: double-channel cut fixed-exit Si(111) / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.97974 Å / Relative weight: 1
Reflection	Resolution: 3.79→48.83 Å / Num. obs: 243648 / % possible obs: 99.3 % / Redundancy: 20 % / R_merge(I) obs: 0.383 / Net I/σ(I): 8.8
Reflection shell	Resolution: 3.79→3.86 Å / Redundancy: 16.7 % / R_merge(I) obs: 3.826 / Mean I/σ(I) obs: 0.9 / % possible all: 87.5

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Processing

Software

Name	Version	Classification
PHENIX	(phenix.refine: 1.9_1692)	refinement
XDS		data reduction
Aimless		data scaling
PHENIX		phasing

Refinement

Method to determine structure:

SAD / Resolution: 3.796→48.828 Å / SU ML: 0.61 / Cross valid method: FREE R-VALUE / σ(F): 1.33 / Phase error: 33.07 / Stereochemistry target values: MLHL

	R_factor	Num. reflection	% reflection
R_free	0.2994	11988	5.01 %
R_work	0.2855	-	-
obs	0.2862	239257	99.05 %

Solvent computation

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

Refinement step

Cycle: LAST / Resolution: 3.796→48.828 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	46471	0	0	0	46471

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.005	47465
X-RAY DIFFRACTION	f_angle_d	1.241	64783
X-RAY DIFFRACTION	f_dihedral_angle_d	13.012	16217
X-RAY DIFFRACTION	f_chiral_restr	0.049	7512
X-RAY DIFFRACTION	f_plane_restr	0.005	8406

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 (%)
3.7956-3.8387	0.4695	298	0.3978	5686	X-RAY DIFFRACTION	74
3.8387-3.8838	0.3809	382	0.3835	7658	X-RAY DIFFRACTION	100
3.8838-3.9312	0.3922	432	0.3775	7555	X-RAY DIFFRACTION	100
3.9312-3.9809	0.3891	395	0.369	7714	X-RAY DIFFRACTION	100
3.9809-4.0333	0.3771	375	0.3539	7637	X-RAY DIFFRACTION	100
4.0333-4.0885	0.3558	400	0.3603	7665	X-RAY DIFFRACTION	100
4.0885-4.1469	0.3565	418	0.3543	7635	X-RAY DIFFRACTION	100
4.1469-4.2087	0.3557	432	0.3488	7586	X-RAY DIFFRACTION	100
4.2087-4.2745	0.3624	378	0.3483	7708	X-RAY DIFFRACTION	100
4.2745-4.3445	0.3447	394	0.3413	7650	X-RAY DIFFRACTION	100
4.3445-4.4194	0.3674	443	0.3296	7596	X-RAY DIFFRACTION	100
4.4194-4.4997	0.3527	382	0.321	7689	X-RAY DIFFRACTION	100
4.4997-4.5862	0.322	459	0.3117	7595	X-RAY DIFFRACTION	100
4.5862-4.6797	0.3213	415	0.31	7649	X-RAY DIFFRACTION	100
4.6797-4.7814	0.2959	357	0.2964	7676	X-RAY DIFFRACTION	100
4.7814-4.8925	0.3241	372	0.2954	7654	X-RAY DIFFRACTION	100
4.8925-5.0147	0.2965	419	0.2919	7612	X-RAY DIFFRACTION	100
5.0147-5.1502	0.3082	395	0.3056	7612	X-RAY DIFFRACTION	100
5.1502-5.3015	0.3296	404	0.2983	7726	X-RAY DIFFRACTION	100
5.3015-5.4724	0.3186	420	0.3009	7621	X-RAY DIFFRACTION	100
5.4724-5.6678	0.3768	371	0.303	7696	X-RAY DIFFRACTION	100
5.6678-5.8943	0.3167	389	0.3272	7632	X-RAY DIFFRACTION	100
5.8943-6.1621	0.3084	394	0.3259	7637	X-RAY DIFFRACTION	100
6.1621-6.4863	0.3392	407	0.303	7634	X-RAY DIFFRACTION	100
6.4863-6.8916	0.3243	402	0.2893	7686	X-RAY DIFFRACTION	100
6.8916-7.422	0.3002	398	0.2729	7659	X-RAY DIFFRACTION	100
7.422-8.1658	0.2588	406	0.2453	7643	X-RAY DIFFRACTION	100
8.1658-9.3403	0.2115	394	0.2116	7663	X-RAY DIFFRACTION	100
9.3403-11.7407	0.1805	419	0.1699	7541	X-RAY DIFFRACTION	99
11.7407-48.8321	0.2497	438	0.2357	7554	X-RAY DIFFRACTION	99

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	2.3492	-0.0158	-1.8404	0.4447	0.7909	2.0931	0.2899	-0.0913	0.454	0.204	-0.0972	-0.0538	-0.2209	-0.1122	-0.1549	1.1851	-0.1147	-0.0151	1.0695	-0.0265	1.0466	9.1547	-53.7609	106.8448
2	3.0628	-1.5532	-0.7364	2.3707	0.3095	3.4803	0.9837	-0.2453	0.1502	-0.3365	-0.9638	-0.9692	-0.8084	2.0607	-0.0816	1.3635	-0.1476	0.1458	1.6289	-0.0018	1.2624	7.0201	-57.1176	124.3091
3	3.3146	-0.584	-0.006	2.0057	-0.6495	3.0567	-0.0715	-0.2332	-0.7087	0.3013	-0.0027	-0.3964	0.6443	0.6646	0.1924	1.3326	-0.1516	-0.1006	1.3285	-0.0065	1.1631	4.3386	-74.9978	123.4151
4	2.7193	2.074	-0.828	4.0061	-0.4112	2.402	0.4404	-0.4771	0.4348	0.6138	-0.4512	0.1573	-0.5139	-0.0405	0.093	1.1918	-0.0031	0.0182	1.1434	-0.1086	1.0872	-6.5792	-49.9052	122.0285
5	1.8628	-1.1739	1.3386	1.5093	-0.0261	1.6269	0.2207	0.4171	1.6293	0.2954	-0.7212	0.0324	-0.377	0.021	0.5851	2.4905	-0.4174	0.5872	1.6814	-0.3601	1.9689	-9.5166	-26.6483	133.7398
6	2.3541	2.5172	1.231	5.5168	2.7917	2.7893	0.5328	0.1442	-1.6565	0.1106	0.5533	-2.8807	0.7174	-0.1226	-0.8774	1.3277	-0.0497	-0.1328	1.4412	-0.0683	1.7355	-23.5782	-51.6888	75.4043
7	0.8044	1.0091	0.8345	2.6847	0.3337	1.9014	0.166	0.1222	0.1761	0.0818	0.0274	0.2827	0.0315	-0.0103	-0.1522	0.9274	0.0737	-0.0216	1.2647	-0.0904	1.1705	-49.7705	-77.2148	80.7682
8	1.6164	-1.4594	1.4446	3.2676	0.6756	3.5985	0.4055	-0.433	0.0347	0.4708	-0.167	0.4317	0.7363	-0.4	-0.2529	1.0452	-0.0805	0.0368	0.9858	0.0041	1.2066	-42.2182	-73.4177	99.5618
9	3.0097	-0.5777	0.4449	1.5075	0.2986	3.3763	0.4594	-0.084	-0.6299	0.0234	0.038	0.6271	0.5643	-0.7013	-0.3909	1.1967	0.0155	-0.1336	1.2247	-0.0404	1.3842	-48.0002	-77.9483	92.7979
10	0.6748	-0.0795	-0.0281	2.853	-1.6551	3.4233	-0.0997	-0.053	0.1101	0.2905	-0.0846	-0.107	-0.4769	-0.284	0.1852	0.7575	0.0572	0.0313	1.1323	-0.1349	1.1879	-35.6829	-51.3933	82.0718
11	2.2355	1.5215	-1.4958	4.6067	1.4569	5.1367	-0.3222	-0.6157	0.3154	-0.9408	-0.4116	0.6441	-0.6741	-0.5728	0.6003	1.401	0.1929	-0.0396	1.2675	0.0206	1.3031	-44.359	-40.481	85.4475
12	0.9085	0.137	-0.1934	1.9403	0.2243	3.1522	0.0842	-0.2799	0.2475	0.4865	-0.122	0.1379	-0.5669	-0.2515	0.0142	1.0046	0.1477	-0.0422	1.1022	-0.1099	1.3195	-39.3602	-43.211	88.9584
13	3.0209	-1.3422	0.7459	2.2357	-0.483	2.6399	0.0462	-1.3733	-1.055	0.6686	0.8192	-0.0001	-0.3149	-1.047	-0.5034	0.8783	0.1821	0.3167	1.3151	0.2192	1.6018	-48.6609	5.7559	-34.4354
14	0.5901	-0.4752	1.1784	0.5306	-0.9413	2.2708	0.2345	0.015	0.2012	0.8501	-0.5737	0.905	-1.44	-1.7127	0.5321	1.7215	0.0892	-0.1391	1.6598	-0.1387	1.1884	-34.6712	3.4833	-13.7373
15	0.63	0.6709	1.3687	3.0507	0.4138	4.1453	0.1781	-0.4788	-0.1595	0.441	0.035	-0.523	0.6354	0.9594	0.1456	1.1344	0.078	-0.1015	1.5244	0.08	1.263	-27.4082	-8.7852	-22.1043
16	0.8886	0.2168	0.6994	1.977	-0.1205	1.4419	0.2247	-0.6807	-0.79	0.3018	0.1054	0.765	-0.4291	-0.0749	-0.1889	1.2172	-0.1336	0.0296	1.1927	0.115	1.5475	-43.4644	-10.0481	-29.3707
17	0.5516	-0.4772	-0.3244	0.351	0.3577	0.5606	-0.2447	-0.6107	0.7713	-0.2918	0.6324	0.3505	0.1611	0.7343	-0.197	1.3918	-0.1565	-0.0142	1.225	0.2665	1.8367	-38.5903	-23.2252	-27.8336
18	0.5756	0.1648	0.4515	0.0373	0.1092	0.4858	0.0442	-0.4703	-0.0401	0.6746	-0.0811	1.157	-0.9487	0.3604	-0.383	1.7625	-0.3048	0.4046	1.5624	0.0983	1.9699	-59.489	-21.5254	-28.5214
19	1.4852	0.4712	-0.0458	4.1856	-1.3441	2.157	-0.1705	-0.0475	0.1361	-0.4317	0.2272	0.1542	-0.4101	0.0628	-0.0858	0.5664	0.0462	0.2094	1.0446	-0.1049	0.8944	-37.7605	21.5436	-38.593
20	1.6891	-0.8666	1.7084	0.6809	-1.1626	3.1897	-0.1963	0.7435	0.8013	0.1155	-0.2158	-0.5985	0.1023	0.8968	0.3393	1.3346	0.0581	0.0272	1.2528	0.0725	1.3533	-36.1163	18.0673	-51.235
21	1.1112	0.0583	0.0459	1.1663	0.4426	1.9709	0.1153	0.5774	-0.8528	0.4994	-0.231	-0.4886	0.3913	-1.0275	0.1157	0.9824	-0.0879	-0.1579	1.1875	-0.0226	1.5999	-49.0199	14.4445	-68.6864
22	0.7285	-0.1634	-0.0537	1.8759	0.4788	1.4174	0.1971	0.0186	-0.2153	0.0529	0.1026	-0.0022	0.3612	-0.0576	-0.2858	0.957	-0.098	0.0108	1.1254	0.1361	1.2282	-40.3179	5.7379	-50.31
23	2.7832	-0.8284	1.9737	0.2227	-0.8558	2.8908	0.3098	-0.3855	-0.1889	0.38	-0.0467	0.2434	0.4551	0.1265	-0.2371	1.5643	-0.0991	0.0373	1.2089	-0.1109	1.1432	-13.5945	17.6082	-8.4355
24	3.7405	0.3749	-1.2561	1.7457	0.7588	3.2854	-0.4032	-0.5374	1.3178	0.0087	-0.2029	-0.0581	-1.017	-0.4403	0.3532	1.7676	0.2121	0.101	1.6226	-0.3705	1.4844	-10.5411	39.6762	6.7131
25	1.5454	0.456	0.3316	4.2566	0.1054	2.2702	0.1611	-0.4061	-0.1524	0.9023	-0.0853	0.2841	0.2108	-0.0821	-0.03	1.4243	-0.022	-0.054	1.5133	-0.1434	1.1316	-0.7102	11.8742	6.3794
26	2.5388	-0.5828	-0.1044	2.2066	-0.462	2.4361	-0.7281	-0.2915	-1.6089	1.4125	0.1572	-0.4043	0.653	-0.4516	0.6071	2.5871	-0.0741	0.043	1.7731	-0.0033	1.7178	3.6849	-15.8946	12.2223
27	3.4706	2.3321	-1.7181	2.3821	-1.1974	6.7873	0.8406	-1.6427	0.1007	0.7148	-0.4272	-0.3732	-0.387	2.1235	-0.5977	1.0582	-0.03	-0.0367	1.4268	-0.0615	1.4799	44.6995	-38.9395	86.8538
28	1.3308	-0.3676	-0.1623	3.625	0.8008	0.7347	0.0504	-0.1734	0.3607	0.1313	0.0577	-0.4171	-0.412	0.2123	-0.1115	1.0562	-0.1294	0.0731	1.0766	-0.0739	1.0296	33.6087	-36.3881	89.2268
29	5.9775	-0.1151	-2.3277	2.399	0.8795	4.5647	-0.2526	1.3175	-0.6221	-0.6345	-0.0574	1.1458	0.8175	-1.9427	0.4779	1.1803	0.2247	-0.0073	1.199	-0.0197	1.5057	20.4186	-50.6912	79.6119
30	0.3954	-0.4983	0.2576	1.5257	0.6851	1.0906	0.6232	0.0319	-0.3023	-0.4506	-0.0095	-0.3862	-0.2895	0.4594	-0.6974	1.2468	-0.1683	0.1388	1.2421	-0.2009	1.4676	46.3289	-52.9348	60.2939
31	0.1369	-0.2145	-0.166	1.9778	-0.2549	2.2011	0.0754	0.0845	0.1826	-0.4496	0.1909	-0.298	-0.5084	0.124	-0.1964	1.0244	-0.2176	0.1526	1.2588	-0.057	1.327	37.5381	-40.4242	69.5522
32	1.4098	1.3193	0.8492	1.189	0.8807	0.4054	-0.0221	0.1075	0.1115	-0.1979	0.0409	0.1122	-0.2271	-0.0406	-0.0175	1.6079	0.1616	0.0889	1.2856	-0.0364	1.3354	-7.0813	-11.5754	74.0197
33	2.6901	1.9699	1.8705	1.6462	1.3951	4.0247	-0.1009	-0.0221	-0.0444	0.0701	-0.1864	0.6035	0.1658	-0.3571	0.0434	1.3958	-0.0355	0.0011	1.0315	-0.1135	1.2177	-2.7737	6.8175	94.8491
34	1.9032	1.5234	-0.9776	1.3978	-0.2409	1.9635	-0.3442	-0.574	-0.926	0.9778	-0.2872	-0.6398	1.2495	0.4612	0.0466	1.821	0.0467	0.0178	1.4964	-0.0771	1.434	5.8799	0.0221	111.7035
35	0.8973	0.7752	-1.3309	2.5498	-1.2157	3.214	0.0834	-0.0462	0.2523	0.2666	-0.1559	-0.2112	-0.3802	0.3501	0.0855	1.1863	-0.1384	-0.2661	1.3573	0.0129	1.3979	41.2987	32.762	-27.8581
36	3.4088	0.8168	0.8596	2.8693	0.1914	3.2663	-0.0858	-0.8213	0.479	1.0739	-0.2485	0.2573	-0.6608	-0.0854	0.5615	1.8734	-0.2239	-0.1973	1.5599	-0.2234	1.6023	28.5895	37.3769	-6.3849
37	0.4864	0.8625	0.8258	2.5077	1.2861	4.4046	-0.0047	-0.2861	-0.2097	0.2413	-0.0323	-0.4375	0.7368	0.2104	0.0618	0.8952	0.0109	-0.1357	1.0174	0.1602	0.9827	33.3343	-3.779	-46.7444
38	2.3003	-0.0556	0.3709	2.1529	0.931	2.2917	-0.3404	-0.1176	-0.1946	-0.1405	0.1911	-0.3502	0.9997	0.0918	0.0717	1.4225	-0.0095	-0.1511	1.2167	0.1215	1.1567	31.8733	-5.7075	-25.5642
39	2.2839	1.6517	0.1279	1.4757	0.4179	2.6505	-0.3372	-0.0017	-0.2814	0.054	0.2215	-0.4518	0.688	0.548	0.1655	1.4727	-0.074	-0.1977	1.3842	0.1802	1.0303	30.399	-4.431	-15.2754
40	1.1642	0.1348	-0.3142	1.1575	0.5611	2.5858	-0.0157	-0.5031	-0.0822	0.7165	-0.0792	-0.2211	0.3129	0.3598	0.0738	1.1311	-0.0556	-0.1527	1.1265	0.0698	1.1398	36.9149	6.1726	-24.6351
41	3.5189	-0.476	0.6782	4.8137	0.932	6.1615	0.5287	0.2367	0.4582	-0.4282	-0.155	0.8057	-0.3189	-2.003	0.247	0.7936	-0.039	-0.1451	0.946	0.0416	1.0222	23.5687	10.9645	-62.9366
42	2.9165	1.8143	-1.0882	2.1749	-1.3111	0.5016	-0.001	-0.2321	-0.1322	0.1723	0.0167	0.0537	0.0108	0.0893	0.0988	1.1816	-0.0156	-0.1189	1.1923	0.0228	0.9687	9.3768	-15.4644	-42.9656
43	2.9045	0.7709	-0.7312	1.6069	-0.4329	1.1092	0.5262	0.404	-0.316	0.7082	-0.2274	-1.6148	0.4573	1.1294	0.1836	1.2365	-0.013	-0.1031	1.3606	0.0287	1.6149	6.6136	-33.6644	-45.485
44	2.2496	0.1326	0.0348	1.238	0.3128	1.5112	-0.004	0.0813	-0.5583	-0.1802	-0.0897	-0.1603	0.1777	0.1303	0.1404	1.2234	-0.0137	-0.0083	1.1166	0.044	1.2555	-3.6248	-32.2704	-43.8864
45	2.6126	-1.0223	0.5601	2.0673	0.5556	1.8597	-0.1702	-1.3371	0.2903	0.9548	0.2888	0.1674	-0.8253	-1.1136	-0.0259	1.8058	0.065	0.1218	1.9671	0.291	1.4994	-14.0882	-38.3972	-10.8669

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details
1	X-RAY DIFFRACTION	1	chain 'G' and (resid 340 through 577 )
2	X-RAY DIFFRACTION	2	chain 'G' and (resid 578 through 634 )
3	X-RAY DIFFRACTION	3	chain 'G' and (resid 635 through 742 )
4	X-RAY DIFFRACTION	4	chain 'G' and (resid 743 through 981 )
5	X-RAY DIFFRACTION	5	chain 'G' and (resid 982 through 1087 )
6	X-RAY DIFFRACTION	6	chain 'L' and (resid 228 through 259 )
7	X-RAY DIFFRACTION	7	chain 'L' and (resid 260 through 398 )
8	X-RAY DIFFRACTION	8	chain 'L' and (resid 399 through 431 )
9	X-RAY DIFFRACTION	9	chain 'L' and (resid 432 through 467 )
10	X-RAY DIFFRACTION	10	chain 'L' and (resid 468 through 679 )
11	X-RAY DIFFRACTION	11	chain 'K' and (resid 226 through 294 )
12	X-RAY DIFFRACTION	12	chain 'K' and (resid 295 through 680 )
13	X-RAY DIFFRACTION	13	chain 'E' and (resid 252 through 273 )
14	X-RAY DIFFRACTION	14	chain 'E' and (resid 274 through 314 )
15	X-RAY DIFFRACTION	15	chain 'E' and (resid 315 through 363 )
16	X-RAY DIFFRACTION	16	chain 'E' and (resid 364 through 443 )
17	X-RAY DIFFRACTION	17	chain 'E' and (resid 444 through 489 )
18	X-RAY DIFFRACTION	18	chain 'E' and (resid 490 through 513 )
19	X-RAY DIFFRACTION	19	chain 'E' and (resid 514 through 679 )
20	X-RAY DIFFRACTION	20	chain 'F' and (resid 228 through 294 )
21	X-RAY DIFFRACTION	21	chain 'F' and (resid 295 through 322 )
22	X-RAY DIFFRACTION	22	chain 'F' and (resid 323 through 679 )
23	X-RAY DIFFRACTION	23	chain 'D' and (resid 340 through 636 )
24	X-RAY DIFFRACTION	24	chain 'D' and (resid 637 through 728 )
25	X-RAY DIFFRACTION	25	chain 'D' and (resid 729 through 1008 )
26	X-RAY DIFFRACTION	26	chain 'D' and (resid 1009 through 1088 )
27	X-RAY DIFFRACTION	27	chain 'H' and (resid 250 through 274 )
28	X-RAY DIFFRACTION	28	chain 'H' and (resid 275 through 679 )
29	X-RAY DIFFRACTION	29	chain 'I' and (resid 229 through 259 )
30	X-RAY DIFFRACTION	30	chain 'I' and (resid 260 through 294 )
31	X-RAY DIFFRACTION	31	chain 'I' and (resid 295 through 679 )
32	X-RAY DIFFRACTION	32	chain 'J' and (resid 340 through 981 )
33	X-RAY DIFFRACTION	33	chain 'J' and (resid 982 through 1024 )
34	X-RAY DIFFRACTION	34	chain 'J' and (resid 1025 through 1096 )
35	X-RAY DIFFRACTION	35	chain 'C' and (resid 227 through 494 )
36	X-RAY DIFFRACTION	36	chain 'C' and (resid 495 through 548 )
37	X-RAY DIFFRACTION	37	chain 'C' and (resid 549 through 683 )
38	X-RAY DIFFRACTION	38	chain 'B' and (resid 225 through 336 )
39	X-RAY DIFFRACTION	39	chain 'B' and (resid 337 through 398 )
40	X-RAY DIFFRACTION	40	chain 'B' and (resid 399 through 657 )
41	X-RAY DIFFRACTION	41	chain 'B' and (resid 658 through 680 )
42	X-RAY DIFFRACTION	42	chain 'A' and (resid 340 through 579 )
43	X-RAY DIFFRACTION	43	chain 'A' and (resid 580 through 636 )
44	X-RAY DIFFRACTION	44	chain 'A' and (resid 637 through 997 )
45	X-RAY DIFFRACTION	45	chain 'A' and (resid 998 through 1097 )

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