PDB-4lty: Crystal Structure of E.coli SbcD at 1.8 A Resolution

ID or keywords:

Entry

Database: PDB / ID: 4lty

Title

Crystal Structure of E.coli SbcD at 1.8 A Resolution

Components

Exonuclease subunit SbcD

Keywords

HYDROLASE / meiotic recombination 11 homolog / double-strand break repair protein / nuclease / endonuclease / exonuclease

Function / homology

Double Stranded RNA Binding Domain - #720 / Metallo-dependent phosphatases / Purple Acid Phosphatase; chain A, domain 2 / Double Stranded RNA Binding Domain / 4-Layer Sandwich / 2-Layer Sandwich / Alpha Beta / :

Function and homology information

Biological species

Escherichia coli (E. coli)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

SAD / Resolution: 1.8 Å

Authors

Liu, S. / Tian, L.F. / Yan, X.X. / Liang, D.C.

Citation

Journal: Acta Crystallogr.,Sect.D / Year: 2014
Title: Structural basis for DNA recognition and nuclease processing by the Mre11 homologue SbcD in double-strand breaks repair.
Authors: Liu, S. / Tian, L.F. / Liu, Y.P. / An, X.M. / Tang, Q. / Yan, X.X. / Liang, D.C.

History

Deposition	Jul 24, 2013	Deposition site: RCSB / Processing site: PDBJ
Revision 1.0	Feb 26, 2014	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 / 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

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

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Related structure data

Related structure data	4lu9C 4m0vC C: citing same article (ref.)
Similar structure data	1xp4-2 3thn-d 1nf3-2 5ncm-d 1xp4-4 4m0v-1 1hxd-2 4dnc-1 4o4k-2 4lu9-2 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 - HomologyF&H Search

Related structure data

4lu9C

4m0vC

C: citing same article (ref.)

Similar structure data

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Links

PDB pages	PDBj / wwPDB / NCBI

Deposited unit

C: Exonuclease subunit SbcD

B: Exonuclease subunit SbcD

A: Exonuclease subunit SbcD

D: Exonuclease subunit SbcD

hetero molecules

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

1

C: Exonuclease subunit SbcD

hetero molecules

defined by author
39.6 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

2

B: Exonuclease subunit SbcD

hetero molecules

defined by author
39.6 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

3

A: Exonuclease subunit SbcD

hetero molecules

defined by author
39.6 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

4

D: Exonuclease subunit SbcD

hetero molecules

defined by author
39.6 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

Unit cell

Length a, b, c (Å)	62.138, 69.359, 95.023
Angle α, β, γ (deg.)	72.21, 84.10, 83.77
Int Tables number	1
Space group name H-M	P1

#1: Protein	Exonuclease subunit SbcD / Nuclease SbcCD / D subunit Mass: 39467.609 Da / Num. of mol.: 4 / Fragment: UNP RESIDUES 15-354 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli (E. coli) / Strain: ATCC 55124 / KO11 / Gene: sbcD, EKO11_3451, KO11_21615 / Production host: Escherichia coli (E. coli) / References: UniProt: E8Y9D8
#2: Chemical	ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL Mass: 92.094 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: C₃H₈O₃
#3: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 845 / 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: 2.45 Å³/Da / Density % sol: 49.77 %
Crystal grow	Temperature: 293 K / Method: vapor diffusion, hanging drop / pH: 7.5 Details: pH 7.5, VAPOR DIFFUSION, HANGING DROP, temperature 293K

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: SSRF / Beamline: BL17U / Wavelength: 0.97917 Å
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.97917 Å / Relative weight: 1
Reflection	Resolution: 1.8→50 Å / Num. obs: 133390

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Processing

Software

Name	Version	Classification
MAR345dtb		data collection
PHENIX	(phenix.refine: 1.7.3_928)	refinement
HKL-2000		data reduction
HKL-2000		data scaling

Refinement

Method to determine structure:

SAD / Resolution: 1.8→19.857 Å / SU ML: 0.19 / σ(F): 1.96 / Phase error: 19.29 / Stereochemistry target values: ML

	R_factor	Num. reflection	% reflection
R_free	0.193	6634	4.98 %
R_work	0.156	-	-
obs	0.1578	133143	95.96 %

Solvent computation

Shrinkage radii: 1.11 Å / VDW probe radii: 1.3 Å / Solvent model: FLAT BULK SOLVENT MODEL / B_sol: 50.041 Å² / k_sol: 0.343 e/Å³

Displacement parameters

	B_aniso -1	B_aniso -2	B_aniso -3
1-	3.3684 Å²	0.6021 Å²	3.8803 Å²
2-	-	-1.547 Å²	1.0484 Å²
3-	-	-	-1.8214 Å²

Refinement step

Cycle: LAST / Resolution: 1.8→19.857 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	10193	0	24	845	11062

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.008	10739
X-RAY DIFFRACTION	f_angle_d	1.18	14737
X-RAY DIFFRACTION	f_dihedral_angle_d	15.518	3769
X-RAY DIFFRACTION	f_chiral_restr	0.082	1714
X-RAY DIFFRACTION	f_plane_restr	0.005	1939

LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 30

Resolution (Å)	R_factor R_free	Num. reflection R_free	R_factor R_work	Num. reflection R_work	% reflection obs (%)
1.8-1.8204	0.2791	230	0.2306	4207	95
1.8204-1.8418	0.2445	216	0.208	4209	96
1.8418-1.8643	0.2494	241	0.1875	4206	96
1.8643-1.8879	0.2516	213	0.1788	4189	96
1.8879-1.9127	0.1991	225	0.1625	4196	96
1.9127-1.9389	0.2219	205	0.1578	4283	96
1.9389-1.9666	0.2353	239	0.1609	4155	96
1.9666-1.9959	0.2044	239	0.1553	4278	96
1.9959-2.027	0.2013	220	0.1512	4224	97
2.027-2.0602	0.1985	227	0.1504	4243	97
2.0602-2.0957	0.2095	217	0.153	4223	97
2.0957-2.1338	0.1961	238	0.1507	4255	97
2.1338-2.1748	0.1958	214	0.1534	4227	97
2.1748-2.2191	0.2019	220	0.1501	4322	97
2.2191-2.2673	0.195	238	0.1479	4202	97
2.2673-2.32	0.2036	226	0.1479	4285	97
2.32-2.3779	0.1993	211	0.1494	4276	97
2.3779-2.4421	0.2055	214	0.1536	4224	97
2.4421-2.5138	0.2049	210	0.1509	4348	97
2.5138-2.5948	0.1815	232	0.1458	4231	97
2.5948-2.6873	0.2091	232	0.1507	4265	97
2.6873-2.7946	0.2138	224	0.1676	4255	97
2.7946-2.9214	0.2159	220	0.1714	4266	97
2.9214-3.0749	0.2014	215	0.1674	4293	97
3.0749-3.2668	0.1895	242	0.1577	4250	97
3.2668-3.5177	0.1889	236	0.1523	4170	96
3.5177-3.8694	0.1665	205	0.1431	4059	92
3.8694-4.4239	0.1597	202	0.1383	4001	91
4.4239-5.5533	0.1533	204	0.1368	4112	94
5.5533-19.8582	0.186	179	0.1857	4055	91

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	3.3374	1.1786	-1.139	8.5047	-3.4399	5.0465	0.2087	-0.3183	0.2121	0.0703	-0.1732	-0.2407	-0.4497	0.8252	0.0054	0.2284	-0.0789	0.0485	0.2545	-0.0892	0.1278	15.041	64.445	56.558
2	2.1483	-0.1551	-0.6559	3.7053	-2.1648	4.8926	0.0537	-0.0079	0.1662	-0.146	-0.0305	-0.2591	-0.2158	0.4229	-0.0252	0.1577	-0.0377	0.0256	0.1297	-0.0451	0.1403	16.791	68.763	62.038
3	9.4545	-8.0126	3.7393	9.3078	-0.2607	6.5459	0.0482	-0.2334	-0.2015	-0.2223	-0.4599	-0.6251	0.494	1.7101	0.4399	0.263	0.0883	0.0578	0.4586	0.0681	0.1863	14.246	61.144	68.589
4	6.8209	-4.5588	0.3004	6.5822	-1.1594	8.5081	-0.0588	0.008	-0.272	-0.1279	0.0412	-0.0061	0.4416	0.2063	-0.001	0.1554	-0.0379	0.0313	0.1007	-0.0069	0.137	23.495	70.767	67.762
5	5.2745	1.0402	3.5823	3.1278	2.0659	3.0512	-0.1025	0.56	-0.3769	0.0819	0.3977	-0.3682	0.5059	0.5975	-0.2587	0.3094	0.0455	0.0901	0.295	-0.0539	0.2591	32.656	60.755	66.948
6	4.3171	-1.2817	0.0707	6.2376	-0.7616	3.8506	0.0726	0.2161	0.0237	-0.1525	0.1413	0.482	-0.0766	-0.5779	-0.1927	0.1777	0.0116	0.0604	0.257	0.0247	0.1492	35.753	74.449	55.446
7	5.0643	-0.2972	-1.5731	5.9112	-1.1006	3.8556	0.2543	-0.2806	0.3345	0.4079	0.0774	0.3719	-0.6028	-0.261	-0.3028	0.2315	0.0239	0.0816	0.1996	-0.0056	0.1511	31.452	69.22	47.59
8	1.8057	-0.4206	0.3345	8.5453	-1.8946	0.5314	0.1298	-0.5266	0.3776	0.6602	0.0777	-0.2384	-0.988	0.323	-0.1924	0.584	-0.1021	0.1076	0.2411	-0.1513	0.2217	18.004	64.541	47.568
9	6.9142	6.1625	-3.3368	2.0997	-4.3084	3.6748	-0.0804	-0.7433	-0.1129	0.2249	-0.0292	-0.3934	-0.554	0.8946	0.1241	0.4929	-0.1851	0.1188	0.4147	-0.1325	0.2911	20.033	58.26	49.509
10	1.6985	-1.1456	0.603	4.8932	1.5221	1.139	-0.3525	-0.3993	0.6807	0.3936	0.0781	-0.4423	-0.6713	0.3489	0.0955	1.7401	-0.6945	0.1867	-0.1047	-0.623	0.3724	-2.618	72.632	36.962
11	1.3838	-0.4085	0.0673	3.673	0.5491	1.6188	-0.2253	0.1815	-0.1032	-0.7627	0.2914	-0.5394	0.3035	0.0784	-0.0416	1.5767	-0.1356	0.1963	0.4881	-0.1223	0.8422	-3.581	84.659	35.402
12	2.8728	2.5388	2.3336	4.476	1.3622	2.108	-0.2148	0.0819	-0.1577	0.0945	0.1369	-0.5613	-0.6057	0.4142	-0.0688	1.4156	-0.2921	0.2736	0.2566	-0.1719	0.5589	-3.654	76.44	42.808
13	1.8002	-0.3619	0.0208	1.899	0.8442	5.4554	0.0476	0.0863	0.0924	-0.0408	-0.0284	0.1684	-0.0443	-0.4283	0.0044	0.1184	-0.0059	0.0348	0.1578	0.0454	0.1525	31.0749	71.6652	119.21
14	8.1531	7.4632	-5.8865	6.8626	-4.9702	8.9688	-0.0689	0.0298	-0.071	0.166	0.0797	0.1238	0.1312	-0.1208	-0.0777	0.2237	0.014	0.013	0.1273	-0.0033	0.167	32.5262	59.6478	125.3433
15	9.8752	6.5831	3.1059	8.1747	2.5573	1.8057	0.1134	-0.3638	-0.3424	0.2107	-0.1561	-0.0166	0.5325	-0.1851	0.0446	0.2596	0.0073	0.0669	0.2	0.0417	0.159	39.8029	57.8369	116.0244
16	9.572	-6.9158	5.3995	7.1318	-2.9775	3.4305	-0.1267	-0.7308	-0.1592	0.4149	0.125	-0.9577	0.5346	0.6439	0.004	0.3297	0.1686	-0.0706	0.5911	0.1251	0.5276	63.6308	60.3219	125.9367
17	2.0173	7.9343	1.8676	2.0117	-1.3273	9.6257	-0.1836	-0.0321	-1.0363	-0.4943	-0.0022	-1.0563	1.0126	0.7343	0.175	0.2518	0.1406	0.0729	0.2831	0.0367	0.4054	54.3456	59.5835	115.21
18	4.7266	2.6557	0.4747	7.5908	2.2678	4.8319	0.0871	0.0465	-0.1437	-0.0739	-0.1185	-0.3333	0.2472	0.1532	0.0235	0.1163	0.0363	0.0284	0.1846	0.0503	0.1183	46.9466	65.2187	112.1892
19	5.0921	-2.1326	-2.421	2.8061	1.2663	4.0115	0.0959	0.3671	0.2011	-0.2175	-0.0912	-0.2084	-0.1229	0.1927	0.0082	0.1553	-0.0138	0.0494	0.1934	0.0555	0.1506	46.6833	71.5015	108.9701
20	1.3412	2.0965	2.3369	6.744	4.7414	4.4259	-0.1976	0.3854	0.4314	-0.9992	-0.0269	-0.0596	-0.5193	0.5979	0.2336	0.635	-0.0145	0.1736	0.308	0.159	0.5421	38.2121	88.1469	111.016
21	1.4823	0.3918	0.3756	7.8735	-0.6958	0.5495	0.1026	0.2853	0.368	-0.7912	0.0424	-0.0326	-0.8489	-0.161	-0.1664	0.5189	0.0262	0.0759	0.2945	0.1229	0.2508	33.675	83.1834	106.7391
22	2.2954	4.316	-1.0018	8.1259	-1.9248	4.9433	-0.4594	0.8389	0.9684	-0.5729	0.4003	0.4869	-1.0294	-0.6288	0.0792	0.8501	0.1506	0.0599	0.3744	0.1825	0.574	27.4609	98.1119	115.1035
23	2.4125	-0.8897	0.0891	6.9705	0.5655	1.2077	-0.173	-0.1119	0.0425	0.3363	0.0123	-0.4224	-0.2762	0.0958	0.1267	1.7812	0.1028	0.3402	0.4392	0.0264	1.1359	39.8403	108.7333	121.3721
24	3.7004	2.6713	2.5145	1.934	1.9602	7.9769	-0.2317	-0.1424	1.3836	0.1319	-0.2983	-0.1806	-1.0524	-0.4	0.4764	0.7145	0.0463	0.1172	0.2346	0.0227	0.5783	30.8306	99.9278	119.6412
25	2.0133	1.9783	-7.3233	1.9971	9.0365	6.7199	-0.2475	-0.1633	-0.9915	-0.414	0.0339	0.8541	0.3995	0.0383	-0.015	0.2818	0.0131	-0.0231	0.1218	-0.0195	0.2946	13.289	64.019	104.294
26	3.145	-2.4891	-0.1072	3.9512	0.1905	0.5675	-0.0172	-0.0638	-0.0451	0.1107	0.0573	0.1705	0.0494	-0.0157	-0.0417	0.1549	-0.0231	0.029	0.0762	0.0034	0.1093	15.335	82.462	86.187
27	2.1483	4.3022	-2.792	9.713	-5.5256	4.5463	0.0589	-0.0713	-0.0402	0.2354	-0.0877	-0.1712	-0.0056	0.0949	0.0313	0.1247	0.0145	0.0005	0.1099	-0.0164	0.1211	12.303	74.529	82.928
28	8.4953	-9.1791	-1.5203	2.0188	-0.8459	9.5935	-0.3765	-0.3765	0.1434	1.134	0.1222	-0.0396	-0.0441	0.2013	0.2524	0.2385	-0.0419	-0.0308	0.1796	0.0148	0.1868	12.72	67.288	78.296
29	1.6689	-2.1541	0.645	4.5799	-3.5081	4.2966	-0.0634	-0.1546	0.2292	0.2615	0.0336	-0.5388	-0.1558	0.1474	0.0405	0.1231	-0.0105	-0.0059	0.1491	-0.025	0.2293	3.11	67.921	88.135
30	2.7342	1.6196	-2.1308	1.2541	-0.4198	4.0424	0.2127	-0.3607	1.6372	0.0569	-0.7436	-1.4	-2.4394	1.5852	0.52	0.7885	-0.267	0.0105	0.6189	-0.0324	1.1227	-14.868	74.128	80.331
31	4.9113	3.1812	-0.9477	2.0552	-8.781	9.8872	0.2282	0.0515	0.5738	0.3039	-0.3481	-0.9494	-0.4908	0.8135	0.2166	0.2481	-0.0501	0.0981	0.2414	-0.0112	0.4959	-11.67	73.231	89.947
32	2.2709	-0.8174	0.0065	3.1826	-0.3508	0.8467	0.034	0.1784	0.1156	-0.3099	-0.0427	-0.4063	0.0148	0.1045	0.0166	0.1909	-0.0186	0.0651	0.1125	-0.004	0.1664	1.232	79.732	96.098
33	2.7134	0.0376	0.9884	1.3979	-1.0622	1.9848	0.4156	0.8556	-0.6168	-0.8153	-0.2162	0.7763	0.1275	-0.2725	-0.2161	0.4766	0.0485	-0.1411	0.411	-0.09	0.23	16.065	98.234	96.635
34	2.0371	2.2354	4.4063	6.7254	-0.3704	9.1175	0.0764	0.6748	-0.9615	-0.5127	-0.0052	0.1826	0.722	-0.9512	-0.1184	0.2878	0.021	-0.0457	0.3525	-0.0046	0.3763	18.667	103.673	88.508
35	9.7917	5.8148	-0.6688	5.9452	-5.025	8.6866	-0.0166	0.0129	1.3453	-0.7426	0.5328	1.9955	-0.4574	-1.095	-0.5304	0.5021	0.1699	-0.1124	0.5512	0.0256	0.8242	15.366	116.075	83.147
36	2.0102	7.1705	5.3946	8.1876	-2.133	2.015	-0.0875	0.4811	-0.7378	0.1067	-0.0468	-0.4266	-0.7067	-0.2062	0.1602	0.3094	0.0136	-0.0112	0.2627	0.009	0.3442	15.929	106.046	84.062
37	1.8625	0.7117	0.3823	1.6363	0.3693	0.8593	-0.026	0.0872	-0.0196	-0.0404	-0.0119	0.0621	0.0191	-0.0231	0.036	0.1439	0.0029	0.0369	0.0795	0.008	0.1338	22.1821	101.2954	52.6849
38	2.9164	-3.5564	-0.1747	2.0027	6.5248	5.6197	-0.1362	0.1762	0.2843	-0.1102	0.33	-0.6689	0.0825	-0.2149	-0.1996	0.1597	-0.0156	-0.0042	0.1491	0.0405	0.2667	6.0854	101.4674	48.3384
39	1.6896	2.1153	0.4839	4.9594	3.783	4.4957	0.0022	0.0475	0.4183	-0.3186	-0.0805	0.5622	-0.3552	-0.1522	0.0774	0.125	0.0332	-0.0187	0.1382	0.0411	0.2518	8.5318	109.0515	53.0422
40	5.1815	-1.7628	2.0829	2.0006	-0.3968	2.0007	0.1271	-0.147	2.1906	0.7832	-0.0501	1.2259	-2.5003	-1.4046	-0.153	0.7297	0.0723	0.2563	0.4492	-0.1443	1.0083	4.4364	129.5578	65.9437
41	7.2526	7.1173	4.1298	2.0862	7.8271	7.7065	-0.1159	-0.0022	0.4807	-0.3144	-0.2284	0.8918	-0.2972	-0.4885	0.4046	0.2223	0.0745	-0.0077	0.1824	0.0379	0.4689	-0.4063	110.6861	56.8444
42	4.4905	2.94	-1.0004	5.2659	-0.1257	0.2638	-0.1563	-0.0108	0.1938	0.1282	0.1505	0.4981	-0.0724	0.0393	0.016	0.1673	0.0448	0.0383	0.0701	0.0249	0.1919	11.3457	108.3083	63.2704
43	7.0348	5.706	0.8306	9.3357	3.849	2.4836	0.0556	-0.3272	0.4695	0.1598	-0.1505	0.7129	-0.162	-0.2035	0.1115	0.2356	0.0131	0.0699	0.108	0.0268	0.1736	9.758	109.3411	66.4138
44	4.6606	-1.0459	0.0539	1.685	0.8072	2.9287	-0.2029	-0.2526	-0.1453	0.3967	0.0101	0.3095	0.1975	-0.1724	0.1793	0.263	-0.0023	0.0749	0.0812	-0.0031	0.1796	17.3364	102.9964	69.135
45	4.8212	0.8743	1.8544	1.9147	0.4892	2.7982	0.2129	-0.8138	-0.2816	0.5862	-0.2398	-0.249	0.1278	0.204	-0.0126	0.3442	-0.0121	-0.0309	0.259	0.064	0.1818	27.8015	97.3511	71.3495
46	6.752	2.5479	0.4302	2.8475	0.2405	7.3489	-0.1089	-1.0863	0.0229	1.5033	0.2042	-0.7268	0.1688	0.9322	-0.123	0.5115	0.0767	-0.1767	0.5578	-0.0156	0.3157	43.351	106.0394	75.4748
47	7.0911	3.4424	1.3442	8.4342	2.1662	7.8111	-0.052	-0.046	0.5413	0.8302	0.0589	-2.3042	-0.7549	2.2881	-0.0198	0.5543	-0.1219	-0.2874	0.9378	0.0446	0.9789	51.953	108.8128	76.5538
48	9.6227	3.2539	7.1991	9.474	-1.3336	7.0783	-0.0091	-0.5505	0.3063	0.4587	-0.7957	0.5078	-0.6058	0.6043	0.8076	0.2733	-0.0214	-0.0129	0.3487	-0.0216	0.2419	42.7471	108.822	72.9594

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 -2:36 )	A	-2 - 36
2	X-RAY DIFFRACTION	2	( CHAIN A AND RESID 37:64 )	A	37 - 64
3	X-RAY DIFFRACTION	3	( CHAIN A AND RESID 65:72 )	A	65 - 72
4	X-RAY DIFFRACTION	4	( CHAIN A AND RESID 73:107 )	A	73 - 107
5	X-RAY DIFFRACTION	5	( CHAIN A AND RESID 108:120 )	A	108 - 120
6	X-RAY DIFFRACTION	6	( CHAIN A AND RESID 121:202 )	A	121 - 202
7	X-RAY DIFFRACTION	7	( CHAIN A AND RESID 203:240 )	A	203 - 240
8	X-RAY DIFFRACTION	8	( CHAIN A AND RESID 241:261 )	A	241 - 261
9	X-RAY DIFFRACTION	9	( CHAIN A AND RESID 262:279 )	A	262 - 279
10	X-RAY DIFFRACTION	10	( CHAIN A AND RESID 280:309 )	A	280 - 309
11	X-RAY DIFFRACTION	11	( CHAIN A AND RESID 310:329 )	A	310 - 329
12	X-RAY DIFFRACTION	12	( CHAIN A AND RESID 330:338 )	A	330 - 338
13	X-RAY DIFFRACTION	13	( CHAIN B AND RESID -1:92 )	B	-1 - 92
14	X-RAY DIFFRACTION	14	( CHAIN B AND RESID 93:107 )	B	93 - 107
15	X-RAY DIFFRACTION	15	( CHAIN B AND RESID 108:135 )	B	108 - 135
16	X-RAY DIFFRACTION	16	( CHAIN B AND RESID 136:153 )	B	136 - 153
17	X-RAY DIFFRACTION	17	( CHAIN B AND RESID 154:164 )	B	154 - 164
18	X-RAY DIFFRACTION	18	( CHAIN B AND RESID 165:202 )	B	165 - 202
19	X-RAY DIFFRACTION	19	( CHAIN B AND RESID 203:244 )	B	203 - 244
20	X-RAY DIFFRACTION	20	( CHAIN B AND RESID 245:252 )	B	245 - 252
21	X-RAY DIFFRACTION	21	( CHAIN B AND RESID 253:296 )	B	253 - 296
22	X-RAY DIFFRACTION	22	( CHAIN B AND RESID 297:310 )	B	297 - 310
23	X-RAY DIFFRACTION	23	( CHAIN B AND RESID 311:328 )	B	311 - 328
24	X-RAY DIFFRACTION	24	( CHAIN B AND RESID 330:338 )	B	330 - 338
25	X-RAY DIFFRACTION	25	( CHAIN C AND RESID -2:2 )	C	-2 - 2
26	X-RAY DIFFRACTION	26	( CHAIN C AND RESID 3:63 )	C	3 - 63
27	X-RAY DIFFRACTION	27	( CHAIN C AND RESID 64:91 )	C	64 - 91
28	X-RAY DIFFRACTION	28	( CHAIN C AND RESID 92:102 )	C	92 - 102
29	X-RAY DIFFRACTION	29	( CHAIN C AND RESID 103:136 )	C	103 - 136
30	X-RAY DIFFRACTION	30	( CHAIN C AND RESID 137:141 )	C	137 - 141
31	X-RAY DIFFRACTION	31	( CHAIN C AND RESID 148:165 )	C	148 - 165
32	X-RAY DIFFRACTION	32	( CHAIN C AND RESID 166:265 )	C	166 - 265
33	X-RAY DIFFRACTION	33	( CHAIN C AND RESID 266:295 )	C	266 - 295
34	X-RAY DIFFRACTION	34	( CHAIN C AND RESID 301:310 )	C	301 - 310
35	X-RAY DIFFRACTION	35	( CHAIN C AND RESID 311:332 )	C	311 - 332
36	X-RAY DIFFRACTION	36	( CHAIN C AND RESID 333:338 )	C	333 - 338
37	X-RAY DIFFRACTION	37	( CHAIN D AND RESID -3:109 )	D	-3 - 109
38	X-RAY DIFFRACTION	38	( CHAIN D AND RESID 110:117 )	D	110 - 117
39	X-RAY DIFFRACTION	39	( CHAIN D AND RESID 118:140 )	D	118 - 140
40	X-RAY DIFFRACTION	40	( CHAIN D AND RESID 141:151 )	D	141 - 151
41	X-RAY DIFFRACTION	41	( CHAIN D AND RESID 152:173 )	D	152 - 173
42	X-RAY DIFFRACTION	42	( CHAIN D AND RESID 174:201 )	D	174 - 201
43	X-RAY DIFFRACTION	43	( CHAIN D AND RESID 202:225 )	D	202 - 225
44	X-RAY DIFFRACTION	44	( CHAIN D AND RESID 226:247 )	D	226 - 247
45	X-RAY DIFFRACTION	45	( CHAIN D AND RESID 248:298 )	D	248 - 298
46	X-RAY DIFFRACTION	46	( CHAIN D AND RESID 299:317 )	D	299 - 317
47	X-RAY DIFFRACTION	47	( CHAIN D AND RESID 318:331 )	D	318 - 331
48	X-RAY DIFFRACTION	48	( CHAIN D AND RESID 332:340 )	D	332 - 340

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