PDB-5c8j: A YidC-like protein in the archaeal plasma membrane

ID or keywords:

Entry

Database: PDB / ID: 5c8j

Title

A YidC-like protein in the archaeal plasma membrane

Components

Antibody fragment, heavy chain
Antibody fragment, light chain
Protein MJ0480

Keywords

MEMBRANE PROTEIN / membrane protein insertase

Function / homology

Function and homology information

small molecule binding / plasma membrane
Similarity search - Function

Biological species

Homo sapiens (human)

Methanocaldococcus jannaschii (archaea)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT /

molecular replacement / Resolution: 3.502 Å

Authors

Borowska, M.T. / Dominik, P.K. / Anghel, S.A. / Kossiakoff, A.A. / Keenan, R.J.

Funding support

United States, 3items

Organization	Grant number	Country
National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)	R01 GM086487	United States
National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)	U01 GM094588	United States
National Institutes of Health/National Institute of General Medical Sciences (NIH/NIGMS)	U54 GM087519	United States

Citation

Journal: Structure / Year: 2015
Title: A YidC-like Protein in the Archaeal Plasma Membrane.
Authors: Borowska, M.T. / Dominik, P.K. / Anghel, S.A. / Kossiakoff, A.A. / Keenan, R.J.

History

Deposition	Jun 25, 2015	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Sep 2, 2015	Provider: repository / Type: Initial release
Revision 1.1	Sep 16, 2015	Group: Database references
Revision 1.2	Sep 23, 2015	Group: Derived calculations
Revision 1.3	Sep 13, 2017	Group: Author supporting evidence / Derived calculations / Category: pdbx_audit_support / pdbx_struct_oper_list Item: _pdbx_audit_support.funding_organization / _pdbx_struct_oper_list.symmetry_operation
Revision 1.4	Dec 25, 2019	Group: Author supporting evidence / Category: pdbx_audit_support / Item: _pdbx_audit_support.funding_organization
Revision 1.5	Oct 9, 2024	Group: Data collection / Database references / Structure summary Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_entry_details / pdbx_modification_feature Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	5c8j.cif.gz	925.7 KB	Display	PDBx/mmCIF format
PDB format	pdb5c8j.ent.gz	783.7 KB	Display	PDB format
PDBx/mmJSON format	5c8j.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Summary document	5c8j_validation.pdf.gz	759.5 KB	Display	wwPDB validaton report
Full document	5c8j_full_validation.pdf.gz	847.5 KB	Display
Data in XML	5c8j_validation.xml.gz	87.7 KB	Display
Data in CIF	5c8j_validation.cif.gz	117.7 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/c8/5c8j ftp://data.pdbj.org/pub/pdb/validation_reports/c8/5c8j	HTTPS FTP

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Related structure data

Similar structure data	6m3c-2 4rfo-d 4pz6-d 3b9k-2 7cdj-d 4ydj-1 4g80-3 4pz7-d 6puf-2 3rg5-4 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

Similar structure data

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Links

PDB pages	PDBj / wwPDB / NCBI
Related items in Molecule of the Month	#21 - Sep 2001 Antibodies similarity (1) #256 - Apr 2021 SARS-CoV-2 Spike and Antibodies similarity (1)

Deposited unit

A: Antibody fragment, heavy chain

B: Antibody fragment, light chain

C: Antibody fragment, heavy chain

D: Antibody fragment, light chain

E: Antibody fragment, heavy chain

F: Antibody fragment, light chain

G: Antibody fragment, heavy chain

H: Antibody fragment, light chain

I: Protein MJ0480

J: Protein MJ0480

K: Protein MJ0480

L: Protein MJ0480

hetero molecules

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

1

A: Antibody fragment, heavy chain

B: Antibody fragment, light chain

I: Protein MJ0480

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

2

C: Antibody fragment, heavy chain

D: Antibody fragment, light chain

L: Protein MJ0480

hetero molecules

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

3

E: Antibody fragment, heavy chain

F: Antibody fragment, light chain

J: Protein MJ0480

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

4

G: Antibody fragment, heavy chain

H: Antibody fragment, light chain

K: Protein MJ0480

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

Unit cell

Length a, b, c (Å)	180.250, 251.420, 96.110
Angle α, β, γ (deg.)	90.000, 90.000, 90.000
Int Tables number	18
Space group name H-M	P2₁2₁2

#1: Antibody	Antibody fragment, heavy chain Mass: 25591.508 Da / Num. of mol.: 4 Source method: isolated from a genetically manipulated source Details: OBTAINED BY PHAGE DISPLAY FROM A LIBRARY OF HUMAN IGG. ANTIBODY FRAGMENT; THE CDRS ARE COMPLETELY SYNTHETIC Source: (gene. exp.) Homo sapiens (human) / Plasmid: RH2.2 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21-Gold(DE3)
#2: Antibody	Antibody fragment, light chain Mass: 23298.830 Da / Num. of mol.: 4 Source method: isolated from a genetically manipulated source Details: OBTAINED BY PHAGE DISPLAY FROM A LIBRARY OF HUMAN IGG. ANTIBODY FRAGMENT; THE CDRS ARE COMPLETELY SYNTHETIC Source: (gene. exp.) Homo sapiens (human) / Plasmid: RH2.2 / Production host: Escherichia coli (E. coli) / Strain (production host): BL21-Gold(DE3)
#3: Protein	Protein MJ0480 Mass: 24156.955 Da / Num. of mol.: 4 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Methanocaldococcus jannaschii (strain ATCC 43067 / DSM 2661 / JAL-1 / JCM 10045 / NBRC 100440) (archaea) Strain: ATCC 43067 / DSM 2661 / JAL-1 / JCM 10045 / NBRC 100440 Gene: MJ0480 / Plasmid: pET28a / Production host: Escherichia coli (E. coli) / Strain (production host): BL21(DE3) / References: UniProt: Q57904
#4: Sugar	ChemComp-LMT / DODECYL-BETA-D-MALTOSIDE Type: D-saccharide / Mass: 510.615 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: C₂₄H₄₆O₁₁ / Comment: detergent*YM
Has protein modification	Y

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Experiment

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

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Sample preparation

Crystal	Density Matthews: 3.73 Å³/Da / Density % sol: 66.99 %
Crystal grow	Temperature: 293 K / Method: vapor diffusion, hanging drop / Details: 0.08 M calcium acetate and 18% PEG3350

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: APS / Beamline: 24-ID-E / Wavelength: 0.9791 Å
Detector	Type: ADSC QUANTUM 315 / Detector: CCD / Date: Aug 12, 2013
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.9791 Å / Relative weight: 1
Reflection	Resolution: 3.5→76.4 Å / Num. obs: 55459 / % possible obs: 99 % / Redundancy: 6.8 % / Net I/σ(I): 8.9

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Phasing

Phasing	Method: molecular replacement

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Processing

Software

Name	Version	Classification
PHENIX		refinement
xia2		data reduction
PHASER		phasing
PDB_EXTRACT	3.15	data extraction

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT / Resolution: 3.502→89.774 Å / SU ML: 0.51 / Cross valid method: FREE R-VALUE / σ(F): 1.97 / Phase error: 32.56 / Stereochemistry target values: ML

	R_factor	Num. reflection	% reflection
R_free	0.3024	2446	5.08 %
R_work	0.253	45725	-
obs	0.2555	48171	86.24 %

Solvent computation

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

Displacement parameters

B_iso max: 283.73 Å² / B_iso mean: 114.6489 Å² / B_iso min: 34.92 Å²

Refinement step

Cycle: final / Resolution: 3.502→89.774 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	17808	0	81	0	17889
B_iso mean	-	-	195.98	-	-
Num. residues	-	-	-	-	2308

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.002	18336
X-RAY DIFFRACTION	f_angle_d	0.498	24990
X-RAY DIFFRACTION	f_chiral_restr	0.039	2834
X-RAY DIFFRACTION	f_plane_restr	0.004	3083
X-RAY DIFFRACTION	f_dihedral_angle_d	11.746	10743

LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 17

Resolution (Å)	R_factor R_free	Num. reflection R_free	R_factor R_work	Num. reflection R_work	Num. reflection all	% reflection obs (%)
3.502-3.5735	0.4962	35	0.3537	744	779	24
3.5735-3.6512	0.3607	77	0.3232	1310	1387	43
3.6512-3.7362	0.4005	95	0.3386	1757	1852	57
3.7362-3.8296	0.3573	114	0.3098	2159	2273	70
3.8296-3.9331	0.3326	140	0.2998	2505	2645	82
3.9331-4.0489	0.3813	144	0.2963	2915	3059	94
4.0489-4.1796	0.3303	176	0.2858	3081	3257	100
4.1796-4.329	0.3097	189	0.2598	3030	3219	100
4.329-4.5023	0.3541	161	0.2339	3076	3237	100
4.5023-4.7072	0.2543	158	0.2144	3097	3255	100
4.7072-4.9553	0.2675	174	0.2037	3071	3245	100
4.9553-5.2658	0.238	162	0.206	3128	3290	100
5.2658-5.6723	0.2433	145	0.2141	3159	3304	100
5.6723-6.243	0.2798	160	0.2294	3119	3279	100
6.243-7.146	0.325	166	0.252	3149	3315	100
7.146-9.0019	0.2749	174	0.2425	3181	3355	99
9.0019-89.8037	0.3042	176	0.2794	3244	3420	97

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	5.1728	4.3087	-0.4966	6.0789	-0.3617	4.5591	-0.3706	-0.2174	-0.4203	-1.152	0.0498	-0.5758	0.5532	0.1822	0.3345	1.2296	-0.0784	0.0796	0.4467	0.1211	0.8221	-18.833	43.6084	-73.9227
2	7.5565	2.5455	0.8833	7.764	-1.6237	4.2538	0.5045	-0.9363	0.8528	1.1799	0.3322	-0.4424	-0.7218	0.3491	0.3054	1.169	-0.0156	-0.1252	0.6861	-0.1749	0.756	-19.139	55.6292	-56.9969
3	1.5304	1.5425	0.8136	3.2769	0.7718	1.2784	-0.8738	-0.2991	-0.6952	-1.1402	0.0896	0.3082	0.0635	0.1675	0.2105	1.3438	-0.2232	0.3368	0.6351	0.0872	0.719	-27.8722	28.9467	-78.6692
4	0.5182	-1.6966	0.1395	6.6251	1.2462	2.7388	-1.0539	0.479	-1.3659	-1.4465	0.3795	-0.2955	1.3398	-0.1436	0.3161	1.6389	-0.5353	0.4501	0.3514	0.0241	0.8967	-44.5199	9.6549	-77.2348
5	9.3258	0.6313	-2.6058	3.3592	-3.494	7.2426	-0.8475	0.3086	-0.1166	-0.1024	0.6676	-0.1812	0.0202	-0.4694	0.2478	1.0433	-0.1575	0.134	0.5636	-0.1166	0.5527	-40.9572	19.0325	-80.3534
6	5.3331	0.9536	-1.2195	8.2534	-0.4375	5.1681	0.2033	-0.7957	0.1843	1.0304	-0.4291	-1.0241	0.3211	0.4953	0.1458	0.8275	-0.1427	-0.106	0.717	0.1739	0.3761	-25.3951	36.942	-51.6022
7	3.3909	3.2968	1.6438	3.506	1.552	3.6409	-0.1587	-0.5349	0.0708	0.0303	-0.5983	0.0217	0.1252	-0.2202	0.8519	1.1345	0.0525	0.0565	0.4067	0.0238	0.7632	-32.7633	20.8876	-64.4317
8	4.5683	-0.1828	-0.4976	5.187	1.6623	4.7427	0.643	-0.0724	-1.015	0.1303	-0.4769	-1.133	0.6578	-0.3429	-0.0291	1.0888	-0.0995	0.2667	0.5444	-0.0061	0.997	-35.0462	3.7478	-70.2696
9	3.331	1.897	3.1137	8.1752	3.5846	7.323	0.2181	0.4548	-0.2852	-0.4728	-0.6607	0.1226	0.827	0.6438	0.2788	1.2633	0.1545	0.162	0.8617	0.1857	0.363	-27.1324	120.6829	-67.305
10	2.9846	-2.1087	0.4921	4.8188	1.5468	2.7064	0.042	-0.0214	0.3697	0.2188	0.1315	-0.2	-0.635	0.4569	0.0431	1.0634	-0.0585	0.1541	0.4868	0.1742	0.3429	-19.1046	123.6816	-71.0976
11	2.7941	0.0173	-1.4816	2.1648	1.1145	2.971	0.4005	0.5697	-0.2777	-0.5026	-0.7531	-0.8322	0.0151	-0.4257	-0.0929	1.0799	0.0852	-0.0237	0.4641	0.4028	0.7343	-26.1409	125.0285	-74.7366
12	2.9719	3.0028	0.898	4.7732	3.0599	2.9611	-0.9533	0.2638	1.9319	1.0652	-0.7079	-0.037	-2.1192	-0.5017	1.5674	1.1461	0.2167	-0.0155	0.6668	-0.0254	0.8448	-49.252	157.079	-67.0074
13	4.8592	-0.7431	3.0874	3.5091	-0.887	8.4286	-0.5009	0.3554	0.1482	0.9625	-0.3151	0.3137	-0.1192	-0.1893	0.7175	1.1098	-0.0144	0.017	0.4034	-0.057	0.5785	-44.1265	147.2964	-63.2452
14	5.129	-2.63	1.1556	6.7498	-0.67	3.608	0.2098	0.1465	0.4512	-1.3983	-0.4773	-1.3215	-0.3164	0.411	0.178	1.3413	0.1064	0.2917	0.8191	0.3254	0.635	-28.8088	129.3947	-91.1195
15	5.6326	-3.7061	1.16	6.0038	-0.3171	2.7136	0.6286	0.6697	0.8698	-0.7184	-0.6754	-0.1129	-0.2481	0.2271	0.1301	1.3573	-0.0777	0.0629	0.8295	0.2354	0.7028	-27.2519	130.038	-91.1035
16	2.3119	-1.4715	0.1057	4.7983	3.2635	5.1682	-0.2221	0.2347	0.6802	-1.1135	0.1771	-0.1994	-1.0188	0.8966	0.6493	1.4055	0.1574	-0.0528	0.5037	0.1706	0.6805	-40.3319	157.0446	-74.7401
17	3.0155	-0.1219	0.0178	1.5623	0.7654	1.8177	-0.8272	0.575	0.7837	-0.5525	0.0329	0.2081	-1.1652	-0.1184	0.4216	1.3827	-0.0109	-0.2664	0.7633	0.3384	0.9922	-37.6551	155.0646	-76.4487
18	2.7975	0.8556	2.0492	3.8387	1.8565	3.7881	0.1065	-0.2927	0.7026	-1.0787	-0.2484	0.3222	-1.0612	-1.3005	0.7501	1.5274	0.2716	-0.1053	0.5672	0.1151	0.8288	-39.7921	165.8272	-70.3872
19	4.9592	-3.6338	2.8773	9.7418	-3.6057	3.8617	0.0798	0.2735	0.5795	-0.6422	-0.2187	-1.1652	-0.4445	0.2002	0.1597	1.5056	0.0607	0.0039	0.2143	0.094	0.3644	-31.6866	121.515	-51.1564
20	4.2278	1.4662	2.1948	4.0446	-1.1291	2.1916	0.6431	-0.0869	-0.0387	-0.618	-0.4289	-0.2587	-0.1999	-0.4893	-0.0725	1.5119	0.0176	0.2126	0.7478	-0.0393	0.4695	-37.3779	111.8974	-49.5351
21	1.929	0.593	2.3581	3.3561	-1.1191	4.0041	-0.401	-0.3862	0.4524	0.0307	0.1774	-0.0415	-0.0866	-0.445	-0.7098	1.599	0.0771	0.2708	0.6005	0.128	0.2685	-37.4633	120.4984	-44.8035
22	0.9847	-0.2925	1.8303	0.0839	-0.5361	3.4004	0.703	-0.1002	-1.9734	0.83	1.3678	0.2715	1.249	-0.1355	-1.2714	1.449	0.3828	-0.0616	0.6738	0.0607	2.2432	-35.7548	94.965	-43.3205
23	1.1466	0.8887	-0.411	3.008	0.1146	0.139	0.5245	-0.163	0.2134	-0.4349	-0.5468	0.2453	0.1459	-0.1052	-0.2851	1.77	0.1118	0.317	0.4463	0.2347	0.183	-28.0697	129.6604	-43.5101
24	3.1517	-3.5712	1.0504	6.8191	-4.493	4.3808	-0.1437	-0.3682	1.4314	2.4934	-0.9017	-1.3095	-1.6047	1.0216	1.645	1.9317	-0.3907	0.237	0.5794	0.3773	0.9215	-9.8759	145.8657	-28.1488
25	4.2283	-0.0759	2.2208	1.8428	-1.4706	4.8526	0.3267	-0.3294	1.2041	0.092	-0.2349	-0.2096	0.5863	0.4491	-0.5014	1.2308	0.2005	0.0496	0.6557	0.0342	0.4998	-20.7756	136.6112	-37.7038
26	1.9613	-0.389	1.5719	3.5275	-2.169	4.164	-0.101	-0.0889	-0.0839	0.3847	-0.9131	-1.3446	-1.7062	1.4254	0.4724	1.4212	0.4223	0.2363	2.0684	1.1262	0.5226	-5.6404	142.0787	-31.8807
27	9.6002	2.4815	3.2546	3.9877	-1.1964	5.891	-0.5973	0.6316	0.2259	-0.0067	-0.0149	-0.7737	-0.9242	1.9182	1.0251	1.3122	-0.035	0.1483	1.0226	0.2968	0.7323	-14.0811	143.3779	-42.9434
28	2.3232	1.7592	-2.3588	3.707	-2.3059	4.0529	0.4427	-0.6429	0.039	1.55	-0.459	-0.4879	1.2613	0.5778	0.2283	1.9763	-0.0068	0.2041	0.6352	0.3624	0.3937	-27.8592	106.9451	-28.5259
29	4.6943	0.3299	2.8211	1.0426	1.0973	3.185	0.7392	-0.9135	-1.0623	1.0869	-0.5046	-0.5387	0.3236	0.4708	0.1725	1.8359	0.0467	0.0089	0.871	0.2825	0.5975	-25.8476	106.7083	-26.0964
30	9.7441	1.1747	3.7139	6.0231	0.9642	5.148	0.0668	-1.7909	-0.0642	1.7043	-0.9895	0.6756	-0.8852	0.3833	0.5202	1.071	0.0112	0.3438	1.0412	0.1363	0.5844	-38.2173	108.926	-33.2308
31	5.2899	-0.3462	-0.9739	5.911	4.2692	3.1851	-0.9713	-0.6102	-0.4284	1.7847	0.0549	-0.4541	-1.1117	-0.3885	-0.0143	1.31	-0.138	-0.1909	0.9596	0.1468	0.4717	-15.0184	125.5839	-18.5718
32	1.0047	-0.1457	1.534	2.8717	-1.7688	3.328	-0.0766	1.1586	0.2942	-0.5819	0.343	-0.3299	-0.096	0.1835	1.0901	1.1044	-0.9221	0.1672	1.1065	0.4449	0.7435	-19.2933	152.0117	-31.6705
33	2.6013	-0.2996	1.1937	2.5549	-1.5538	5.7095	0.3129	0.1083	-0.5791	-0.1126	-0.5647	0.1548	0.054	-0.4397	0.1777	1.1947	-0.1186	0.2103	0.9037	0.0441	0.5968	-21.3967	137.956	-21.5901
34	7.6017	-1.4546	1.3433	3.9063	-1.2081	2.4898	-1.1416	-1.6914	1.5587	0.5287	0.2951	-0.1021	-1.2381	0.4457	0.4748	1.5669	0.1211	0.0112	0.9227	-0.3178	0.7728	-21.1616	148.0838	-20.0432
35	4.8849	-1.4958	0.907	6.5421	-1.0529	3.3977	-0.5643	0.1949	0.0379	0.9172	-0.1878	-0.4576	-0.2604	-0.3281	1.064	1.1678	-0.0176	0.0435	0.8635	-0.1449	0.5966	-29.8166	50.6662	-93.272
36	3.6438	-0.778	1.0706	3.6675	2.8449	6.5624	0.0321	0.3913	-0.2502	0.8043	-0.8411	0.5271	1.4593	-1.9378	0.9209	1.5289	-0.4077	0.0093	1.2683	-0.2261	0.4915	-36.9765	51.1924	-95.9283
37	2.2636	-1.6176	-0.4988	1.5321	0.7935	1.2667	0.5373	0.0248	0.1933	-0.7197	0.2469	0.7437	-0.0757	-1.5086	-0.0387	2.0131	0.1328	-1.1329	1.9649	1.0094	3.1649	-34.3377	70.7384	-100.7145
38	0.5699	0.7498	0.5691	5.0248	-1.363	3.7892	-0.2155	0.4319	-0.179	-0.8616	-0.7448	-1.7412	1.0273	0.3821	0.5377	1.1003	-0.0793	0.3386	1.144	-0.0146	0.9172	-19.2361	32.0379	-105.1549
39	6.2332	-0.3116	-0.5772	7.3535	-2.6484	9.3239	-0	0.1432	-0.2305	-1.0862	-0.8682	-0.4931	0.5157	1.1794	0.9594	1.5669	-0.2703	0.3589	1.0702	-0.2009	0.7572	-16.3307	28.5795	-106.883
40	4.8855	3.4188	-1.4774	3.6123	1.6815	6.6087	-1.9801	-0.1744	-1.1468	2.6256	1.5144	0.0698	2.3164	0.4458	1.4202	2.1939	0.5231	0.6839	1.0982	0.2788	0.8916	-7.6681	24.202	-104.4334
41	2.7407	-2.6834	-1.0468	2.6613	1.055	2.4926	1.0689	0.4081	0.5433	0.012	-0.5216	0.4311	-3.0151	-0.7876	-0.636	2.9889	0.5405	0.0643	0.9724	0.2006	0.7989	-26.618	54.477	-121.7195
42	1.0125	0.029	-0.3922	1.4121	-2.2331	4.9848	0.4373	1.193	0.2033	-1.3885	-0.5729	-0.3871	-1.0638	-0.2431	-1.0016	2.4375	0.0063	0.5856	0.6735	0.4523	-0.7006	-25.3651	60.8221	-112.9146
43	4.5886	1.7128	-3.3065	1.6583	0.8042	6.1587	-0.4711	0.3799	-0.1307	-0.1212	-0.1639	-1.4839	-0.3068	-0.306	0.2179	1.4958	0.0492	0.1372	0.7994	0.0777	0.6296	-20.9782	43.2049	-117.0819
44	4.3831	-0.0085	-1.123	4.452	-5.2456	6.4858	-1.4758	1.2345	-0.5503	-0.6248	0.5856	0.2581	0.659	-2.0951	-0.0503	2.8011	-0.6446	0.2779	1.8429	0.0435	0.7661	-19.4858	28.91	-126.8121
45	1.9973	-0.3712	0.2999	1.9032	-0.3122	2.3549	-1.2674	0.4609	-0.9742	1.462	-0.004	0.3837	1.7649	-0.003	-0.0752	3.2326	-0.3292	0.8295	1.2478	-0.2657	0.9122	-20.1665	24.4412	-119.5491
46	1.4616	-0.635	0.7543	3.2018	1.7645	3.4236	-0.915	0.7433	-0.9169	0.1597	-0.2266	0.4153	1.4752	-0.0476	-0.9111	2.4522	-0.0958	1.0029	1.3272	-0.835	1.1757	-14.6119	18.6013	-127.4266
47	9.0146	3.4611	1.0876	5.0979	-2.1858	3.5204	0.3494	-1.8115	-0.1653	1.8552	0.03	-0.7665	-0.1883	-0.2953	0.0748	1.3198	-0.3012	-0.7153	0.6588	-0.1923	1.2321	-0.6851	68.6476	-55.8831
48	7.5655	2.2769	-0.6347	3.994	-0.0962	2.0934	0.2465	-0.6661	-1.1234	0.5896	0.0043	0.0643	0.2672	-0.1893	1.8027	0.6729	-0.194	-0.8048	0.6612	0.2054	0.923	2.7737	77.2412	-60.4829
49	6.325	1.9627	-2.5902	7.1735	0.4822	3.588	-0.9587	0.6384	-0.9793	-0.4743	-0.719	-0.2596	1.0215	0.1362	0.9227	1.1088	-0.1391	0.1728	0.6403	0.1371	1.0491	-8.3951	62.2745	-68.0236
50	3.8907	2.8956	-0.7715	9.0912	-4.226	2.9021	1.0857	0.0085	0.3558	0.4999	-0.413	1.4562	-0.2959	-0.4522	-0.3588	0.7051	0.1436	0.1425	0.4309	0.0249	1.3783	-13.9982	85.9388	-67.307
51	5.4039	3.5303	0.2058	6.6749	-4.0526	9.1066	1.2159	-1.1692	0.5126	1.5904	-0.8408	1.5255	-0.9542	0.3945	-0.6617	1.0024	-0.083	0.3323	0.5075	-0.1269	1.263	-11.3208	98.1492	-67.9114
52	1.3255	0.6854	-1.728	6.0983	-3.2945	3.2647	0.3714	0.8312	-0.4804	-1.3834	0.4692	1.551	1.4048	-0.3669	-0.181	0.7868	0.0706	-0.2958	0.7623	0.1154	1.0224	-11.4885	86.888	-84.1248
53	2.3212	3.5539	0.502	6.5856	1.2739	0.3261	0.3964	-1.0569	0.102	0.7564	-0.1142	-1.2597	0.6231	-0.2811	0.0046	0.8113	-1.2523	0.5263	2.8884	-1.4494	2.0961	-61.2966	89.7071	-48.0853
54	6.88	0.6701	3.472	4.8545	0.3736	9.0067	0.882	-0.2287	-2.0107	1.6195	0.1204	1.4127	1.3294	-2.2727	-0.3033	1.2408	-0.3311	0.0385	1.3641	0.0976	1.318	-54.031	80.002	-55.6335
55	3.6795	-0.7445	2.4541	4.7116	5.3443	9.5412	0.9426	1.0883	0.1713	0.9728	-0.6113	0.4861	-0.3992	-1.4879	-0.3007	1.024	-0.1879	0.327	0.9943	-0.124	0.768	-44.7657	87.7601	-62.6441
56	2.8792	0.7016	-2.314	4.2616	0.2247	3.1186	-0.2433	-0.7252	0.6283	0.6039	-1.184	1.1779	0.2333	-0.8956	0.646	1.2347	0.1488	-0.3176	1.2356	-0.2764	0.6965	-44.7147	68.9581	-78.4324
57	1.124	2.9245	-1.6139	8.7143	-3.2373	3.2322	0.8049	0.3636	1.7629	0.1254	0.0019	1.2567	-0.8439	-1.4916	-0.7794	0.8233	0.3972	0.1132	1.051	-0.1426	1.4629	-44.5292	87.8761	-83.73
58	0.0982	-0.0763	-0.0609	0.0641	-0.0048	1.0937	0.0461	0.1989	0.0393	0.0012	-0.2795	0.027	0.1458	-0.1709	-0.4115	1.7177	1.2021	-0.7822	5.5816	-1.6021	1.8803	-60.2483	74.7372	-96.5212
59	4.3472	-5.8131	-1.6837	9.3941	3.1769	1.57	1.0768	-0.6241	1.9724	-1.9391	0.3089	-0.5807	-1.5851	0.2029	-0.6185	2.956	0.665	0.3316	1.4249	-0.684	1.6175	-47.5873	84.7015	-92.3812
60	5.2698	-1.0224	-2.5397	9.1502	5.7367	6.1267	-0.1054	0.9519	0.0349	-0.7248	-0.3682	1.361	-0.0771	-1.0104	0.0537	0.9247	-0.008	-0.0637	1.3167	-0.0648	0.748	-49.4108	80.0523	-83.3569
61	2.2554	-4.2228	0.9288	9.0194	-4.4417	6.9551	0.3447	0.1547	0.4354	-0.9467	0.6562	-0.1953	-1.1333	-1.4691	0.1227	0.7766	0.1272	0.1439	1.1459	-0.5284	1.9227	-45.808	96.2591	-65.9489
62	8.8129	5.1858	3.3122	5.2902	0.5156	2.8961	0.8206	-1.1652	-2.4335	-0.7077	0.7568	-0.9708	1.6958	0.9388	-1.1965	1.2563	0.1501	-0.1739	1.0855	-0.3372	2.1251	-44.4921	77.4665	-60.4552
63	6.8691	-3.9054	-0.6007	2.1405	0.2524	1.7444	-0.4382	1.403	0.1623	-1.5557	-0.6382	-1.4314	0.4852	-0.1833	-0.1673	1.1634	0.1142	0.754	0.3624	0.1262	1.1422	-1.109	98.3117	-87.3615
64	8.3559	-4.8144	-2.5258	3.1662	1.8959	3.1757	0.2669	0.3411	-1.7451	1.6214	-0.2457	0.5957	0.7968	0.3933	0.0717	1.0961	0.1044	-0.0524	0.751	-0.0587	1.3181	2.0566	94.0384	-81.0439
65	3.4305	1.0051	1.3083	2.4882	0.4819	1.3336	0.0612	0.3419	-0.3355	-0.1629	-0.5043	-0.9192	0.0354	-0.0584	-0.1343	0.4953	-0.1536	0.0659	0.4076	0.0467	0.4116	-14.0652	89.4775	-76.09
66	6.9303	2.7115	-0.6133	6.8758	2.5692	5.5181	0.7922	-0.8158	-0.0228	0.8162	-0.5327	1.0174	-0.2997	0.5941	-0.3103	1.4	-0.0443	0.0939	0.5771	0.2026	0.9509	-11.0626	75.6832	-65.8653

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details	Auth asym-ID
1	X-RAY DIFFRACTION	1	chain 'A' and (resid 4 through 102 )	A
2	X-RAY DIFFRACTION	2	chain 'A' and (resid 103 through 117 )	A
3	X-RAY DIFFRACTION	3	chain 'A' and (resid 118 through 142 )	A
4	X-RAY DIFFRACTION	4	chain 'A' and (resid 143 through 163 )	A
5	X-RAY DIFFRACTION	5	chain 'A' and (resid 164 through 232 )	A
6	X-RAY DIFFRACTION	6	chain 'B' and (resid 2 through 76 )	B
7	X-RAY DIFFRACTION	7	chain 'B' and (resid 77 through 140 )	B
8	X-RAY DIFFRACTION	8	chain 'B' and (resid 141 through 215 )	B
9	X-RAY DIFFRACTION	9	chain 'C' and (resid 3 through 36 )	C
10	X-RAY DIFFRACTION	10	chain 'C' and (resid 37 through 102 )	C
11	X-RAY DIFFRACTION	11	chain 'C' and (resid 103 through 141 )	C
12	X-RAY DIFFRACTION	12	chain 'C' and (resid 142 through 161 )	C
13	X-RAY DIFFRACTION	13	chain 'C' and (resid 162 through 234 )	C
14	X-RAY DIFFRACTION	14	chain 'D' and (resid 2 through 64 )	D
15	X-RAY DIFFRACTION	15	chain 'D' and (resid 65 through 103 )	D
16	X-RAY DIFFRACTION	16	chain 'D' and (resid 104 through 151 )	D
17	X-RAY DIFFRACTION	17	chain 'D' and (resid 152 through 173 )	D
18	X-RAY DIFFRACTION	18	chain 'D' and (resid 174 through 215 )	D
19	X-RAY DIFFRACTION	19	chain 'E' and (resid 4 through 20 )	E
20	X-RAY DIFFRACTION	20	chain 'E' and (resid 21 through 86 )	E
21	X-RAY DIFFRACTION	21	chain 'E' and (resid 87 through 102 )	E
22	X-RAY DIFFRACTION	22	chain 'E' and (resid 103 through 117 )	E
23	X-RAY DIFFRACTION	23	chain 'E' and (resid 118 through 142 )	E
24	X-RAY DIFFRACTION	24	chain 'E' and (resid 143 through 161 )	E
25	X-RAY DIFFRACTION	25	chain 'E' and (resid 162 through 195 )	E
26	X-RAY DIFFRACTION	26	chain 'E' and (resid 196 through 210 )	E
27	X-RAY DIFFRACTION	27	chain 'E' and (resid 211 through 233 )	E
28	X-RAY DIFFRACTION	28	chain 'F' and (resid 2 through 64 )	F
29	X-RAY DIFFRACTION	29	chain 'F' and (resid 65 through 91 )	F
30	X-RAY DIFFRACTION	30	chain 'F' and (resid 92 through 103 )	F
31	X-RAY DIFFRACTION	31	chain 'F' and (resid 104 through 116 )	F
32	X-RAY DIFFRACTION	32	chain 'F' and (resid 117 through 129 )	F
33	X-RAY DIFFRACTION	33	chain 'F' and (resid 130 through 173 )	F
34	X-RAY DIFFRACTION	34	chain 'F' and (resid 174 through 214 )	F
35	X-RAY DIFFRACTION	35	chain 'G' and (resid 4 through 43 )	G
36	X-RAY DIFFRACTION	36	chain 'G' and (resid 44 through 102 )	G
37	X-RAY DIFFRACTION	37	chain 'G' and (resid 103 through 117 )	G
38	X-RAY DIFFRACTION	38	chain 'G' and (resid 118 through 152 )	G
39	X-RAY DIFFRACTION	39	chain 'G' and (resid 153 through 195 )	G
40	X-RAY DIFFRACTION	40	chain 'G' and (resid 196 through 232 )	G
41	X-RAY DIFFRACTION	41	chain 'H' and (resid 2 through 19 )	H
42	X-RAY DIFFRACTION	42	chain 'H' and (resid 20 through 64 )	H
43	X-RAY DIFFRACTION	43	chain 'H' and (resid 65 through 140 )	H
44	X-RAY DIFFRACTION	44	chain 'H' and (resid 141 through 151 )	H
45	X-RAY DIFFRACTION	45	chain 'H' and (resid 152 through 189 )	H
46	X-RAY DIFFRACTION	46	chain 'H' and (resid 190 through 214 )	H
47	X-RAY DIFFRACTION	47	chain 'I' and (resid 5 through 44 )	I
48	X-RAY DIFFRACTION	48	chain 'I' and (resid 45 through 121 )	I
49	X-RAY DIFFRACTION	49	chain 'I' and (resid 122 through 143 )	I
50	X-RAY DIFFRACTION	50	chain 'I' and (resid 144 through 161 )	I
51	X-RAY DIFFRACTION	51	chain 'I' and (resid 162 through 175 )	I
52	X-RAY DIFFRACTION	52	chain 'I' and (resid 176 through 194 )	I
53	X-RAY DIFFRACTION	53	chain 'J' and (resid 5 through 22 )	J
54	X-RAY DIFFRACTION	54	chain 'J' and (resid 23 through 121 )	J
55	X-RAY DIFFRACTION	55	chain 'J' and (resid 122 through 161 )	J
56	X-RAY DIFFRACTION	56	chain 'J' and (resid 162 through 175 )	J
57	X-RAY DIFFRACTION	57	chain 'J' and (resid 176 through 194 )	J
58	X-RAY DIFFRACTION	58	chain 'K' and (resid 5 through 22 )	K
59	X-RAY DIFFRACTION	59	chain 'K' and (resid 23 through 42 )	K
60	X-RAY DIFFRACTION	60	chain 'K' and (resid 43 through 161 )	K
61	X-RAY DIFFRACTION	61	chain 'K' and (resid 162 through 175 )	K
62	X-RAY DIFFRACTION	62	chain 'K' and (resid 176 through 194 )	K
63	X-RAY DIFFRACTION	63	chain 'L' and (resid 5 through 98 )	L
64	X-RAY DIFFRACTION	64	chain 'L' and (resid 99 through 130 )	L
65	X-RAY DIFFRACTION	65	chain 'L' and (resid 131 through 161 )	L
66	X-RAY DIFFRACTION	66	chain 'L' and (resid 162 through 194 )	L

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