PDB-6ocd: Ricin A chain bound to VHH antibody V6D4

ID or keywords:

Entry

Database: PDB / ID: 6ocd

Title

Ricin A chain bound to VHH antibody V6D4

Components

Ricin A chain
VHH antibody V6D4

Keywords

TOXIN

Function / homology

Function and homology information

rRNA N-glycosylase /

rRNA N-glycosylase activity / AMP binding / defense response /

toxin activity /

carbohydrate binding / killing of cells of another organism / negative regulation of translation
Similarity search - Function

Biological species

Ricinus communis (castor bean)

Vicugna pacos (alpaca)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT /

molecular replacement / Resolution: 2.103 Å

Authors

Rudolph, M.J.

Funding support

United States, 1items

Citation

Journal: J.Mol.Biol. / Year: 2020
Title: Intracellular Neutralization of Ricin Toxin by Single-domain Antibodies Targeting the Active Site.
Authors: Rudolph, M.J. / Czajka, T.F. / Davis, S.A. / Thi Nguyen, C.M. / Li, X.P. / Tumer, N.E. / Vance, D.J. / Mantis, N.J.

History

Deposition	Mar 22, 2019	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Apr 1, 2020	Provider: repository / Type: Initial release
Revision 1.1	Oct 14, 2020	Group: Database references / Derived calculations Category: citation / citation_author ...citation / citation_author / pdbx_struct_conn_angle / struct_conn Item: _citation.country / _citation.journal_abbrev ..._citation.country / _citation.journal_abbrev / _citation.journal_id_ASTM / _citation.journal_id_CSD / _citation.journal_id_ISSN / _citation.journal_volume / _citation.page_first / _citation.page_last / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year / _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.ptnr1_symmetry / _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.ptnr2_symmetry / _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.ptnr3_symmetry / _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.ptnr1_symmetry / _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_symmetry

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	6ocd.cif.gz	316.3 KB	Display	PDBx/mmCIF format
PDB format	pdb6ocd.ent.gz	266.8 KB	Display	PDB format
PDBx/mmJSON format	6ocd.json.gz		Tree view	PDBx/mmJSON format
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Validation report

Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/oc/6ocd ftp://data.pdbj.org/pub/pdb/validation_reports/oc/6ocd	HTTPS FTP

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Related structure data

Related structure data	6obcC 6obeC 6obgC 6obmC 6oboC 6ocaC C: citing same article (ref.)
Similar structure data	3vcm-1 4z9m-6 4x91-1 2zm7-d 6vhx-2 1k4h-d 3bpt-d 6g5x-2 4g17-d 5ckr-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) 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	#161 - May 2013 Ricin similarity (15) #69 - Sep 2005 Cholera Toxin similarity (15) #21 - Sep 2001 Antibodies similarity (1) #256 - Apr 2021 SARS-CoV-2 Spike and Antibodies similarity (1) #134 - Feb 2011 Integrin similarity (1) #172 - Apr 2014 RecA and Rad51 similarity (1) #194 - Feb 2016 Designer Insulins similarity (1) #234 - Jun 2019 MDM2 and Cancer similarity (1) #259 - Jul 2021 Designed Proteins and Citizen Science similarity (1)

PDB pages

PDBj /

wwPDB /

NCBI

Related items in Molecule of the Month

#161 - May 2013
Ricin
similarity (15)
#69 - Sep 2005
Cholera Toxin
similarity (15)
#21 - Sep 2001
Antibodies
similarity (1)
#256 - Apr 2021
SARS-CoV-2 Spike and Antibodies
similarity (1)
#134 - Feb 2011
Integrin
similarity (1)
#172 - Apr 2014
RecA and Rad51
similarity (1)
#194 - Feb 2016
Designer Insulins
similarity (1)
#234 - Jun 2019
MDM2 and Cancer
similarity (1)
#259 - Jul 2021
Designed Proteins and Citizen Science
similarity (1)

Deposited unit

A: Ricin A chain

B: VHH antibody V6D4

C: Ricin A chain

D: VHH antibody V6D4

hetero molecules

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

1

A: Ricin A chain

B: VHH antibody V6D4

hetero molecules

defined by author
Evidence: surface plasmon resonance
42.4 kDa, 2 polymers
Search similar-shape structures of this assembly by Omokage search (details)

2

C: Ricin A chain

D: VHH antibody V6D4

hetero molecules

defined by author
42.5 kDa, 2 polymers
Search similar-shape structures of this assembly by Omokage search (details)

Unit cell

Length a, b, c (Å)	57.937, 78.605, 103.890
Angle α, β, γ (deg.)	90.000, 96.460, 90.000
Int Tables number	4
Space group name H-M	P12₁1

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Protein / Antibody , 2 types, 4 molecules ACBD

#1: Protein	Ricin A chain Mass: 28903.562 Da / Num. of mol.: 2 / Fragment: Toxin catalytic subunit, residues 40-297 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Ricinus communis (castor bean) / Production host: Escherichia coli (E. coli) / References: UniProt: P02879, rRNA N-glycosylase
#2: Antibody	VHH antibody V6D4 Mass: 13290.563 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Vicugna pacos (alpaca) / Production host: Escherichia coli (E. coli)

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Non-polymers , 5 types, 310 molecules

#3: Chemical	ChemComp-ZN / ZINC ION Mass: 65.409 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: Zn
#4: Chemical	ChemComp-CL / CHLORIDE ION / Chloride Mass: 35.453 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: Cl
#5: Chemical	ChemComp-IMD / IMIDAZOLE / Imidazole Mass: 69.085 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: C₃H₅N₂
#6: Chemical	ChemComp-EDO / 1,2-ETHANEDIOL / ETHYLENE GLYCOL / Ethylene glycol Mass: 62.068 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: C₂H₆O₂
#7: Water	ChemComp-HOH / water / Water Mass: 18.015 Da / Num. of mol.: 301 / 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: 2.79 Å³/Da / Density % sol: 55.99 %
Crystal grow	Temperature: 295 K / Method: vapor diffusion / pH: 6 Details: 100 mM MES (pH 6.0), 400 mM zinc acetate, and 11% PEG 8,000

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Data collection

Diffraction

Mean temperature: 100 K / Serial crystal experiment: N

Diffraction source

Source:

SYNCHROTRON / Site:

APS

/ Beamline: 24-ID-E / Wavelength: 0.979 Å

Detector

Type: ADSC QUANTUM 315 / Detector: CCD / Date: Nov 9, 2016

Radiation

Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray

Radiation wavelength

Wavelength: 0.979 Å / Relative weight: 1

Reflection

Resolution: 2.1→50 Å / Num. obs: 53563 / % possible obs: 99.7 % / Redundancy: 3.6 % / R_merge(I) obs: 0.124 / R_pim(I) all: 0.076 / R_rim(I) all: 0.145 / Χ²: 0.967 / Net I/σ(I): 5.7 / Num. measured all: 193078

Reflection shell

Diffraction-ID: 1

Resolution (Å)	Redundancy (%)	R_merge(I) obs	Num. unique obs	CC_1/2	R_pim(I) all	R_rim(I) all	Χ²	% possible all
2.1-2.14	3.2	1.049	2622	0.518	0.669	1.248	0.653	97.7
2.14-2.18	3.4	0.958	2682	0.495	0.602	1.135	0.678	99.7
2.18-2.22	3.5	0.941	2661	0.542	0.586	1.111	0.668	99.3
2.22-2.26	3.6	0.817	2631	0.663	0.503	0.962	0.701	100
2.26-2.31	3.6	0.713	2710	0.681	0.438	0.839	0.697	99.9
2.31-2.37	3.7	0.662	2621	0.752	0.403	0.776	0.739	100
2.37-2.42	3.6	0.619	2655	0.744	0.378	0.727	0.707	99.8
2.42-2.49	3.6	0.499	2720	0.825	0.304	0.585	0.725	100
2.49-2.56	3.7	0.416	2643	0.866	0.254	0.488	0.741	99.9
2.56-2.65	3.6	0.333	2676	0.92	0.203	0.391	0.775	99.9
2.65-2.74	3.6	0.271	2685	0.942	0.166	0.319	0.777	99.8
2.74-2.85	3.7	0.214	2650	0.963	0.13	0.25	0.829	99.9
2.85-2.98	3.7	0.163	2688	0.974	0.1	0.192	0.856	99.8
2.98-3.14	3.7	0.127	2683	0.983	0.077	0.149	0.926	99.8
3.14-3.33	3.7	0.096	2674	0.989	0.059	0.113	1.074	99.7
3.33-3.59	3.7	0.077	2694	0.991	0.047	0.09	1.266	99.8
3.59-3.95	3.7	0.065	2665	0.994	0.039	0.076	1.535	99.8
3.95-4.52	3.7	0.054	2708	0.995	0.033	0.063	1.714	100
4.52-5.7	3.6	0.045	2733	0.996	0.028	0.053	1.43	100
5.7-50	3.6	0.044	2762	0.997	0.027	0.052	1.662	99.7

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Phasing

Phasing

Method:

molecular replacement

Phasing MR

Model details: Phaser MODE: MR_AUTO

	Highest resolution	Lowest resolution
Rotation	2.1 Å	46.45 Å
Translation	2.1 Å	46.45 Å

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Processing

Software

Name	Version	Classification
HKL-2000		data scaling
PHASER	2.5.6	phasing
PHENIX	(1.11.1_2575)	refinement
PDB_EXTRACT	3.24	data extraction
HKL-2000		data reduction

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT / Resolution: 2.103→46.445 Å / SU ML: 0.58 / Cross valid method: THROUGHOUT / σ(F): 1.35 / Phase error: 24.2

	R_factor	Num. reflection	% reflection
R_free	0.2275	2606	4.87 %
R_work	0.1888	-	-
obs	0.1907	53533	99.08 %

Solvent computation

Shrinkage radii: 0.83 Å / VDW probe radii: 1.1 Å / B_sol: 40.936 Å² / k_sol: 0.346 e/Å³

Displacement parameters

B_iso max: 132.64 Å² / B_iso mean: 46.35 Å² / B_iso min: 14.56 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	7.8677 Å²	-0 Å²	-8.2272 Å²
2-	-	-10.2445 Å²	0 Å²
3-	-	-	2.3768 Å²

Refinement step

Cycle: final / Resolution: 2.103→46.445 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	5867	0	26	301	6194
B_iso mean	-	-	49.73	44.42	-
Num. residues	-	-	-	-	749

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.003	6070
X-RAY DIFFRACTION	f_angle_d	0.671	8240
X-RAY DIFFRACTION	f_chiral_restr	0.049	901
X-RAY DIFFRACTION	f_plane_restr	0.003	1087
X-RAY DIFFRACTION	f_dihedral_angle_d	12.486	2197

LS refinement shell

Refine-ID: X-RAY DIFFRACTION / R_factor R_free error: 0 / Total num. of bins used: 19

Resolution (Å)	R_factor R_free	Num. reflection R_free	R_factor R_work	Num. reflection R_work	Num. reflection all	% reflection obs (%)
2.1027-2.141	0.3456	115	0.2822	2333	2448	86
2.141-2.1821	0.3388	129	0.266	2671	2800	100
2.1821-2.2267	0.3117	139	0.2584	2703	2842	99
2.2267-2.2751	0.3062	150	0.2429	2626	2776	100
2.2751-2.328	0.2728	143	0.2297	2729	2872	100
2.328-2.3862	0.2821	146	0.2156	2671	2817	100
2.3862-2.4507	0.2756	137	0.2286	2693	2830	100
2.4507-2.5229	0.2958	132	0.2156	2687	2819	100
2.5229-2.6043	0.269	125	0.2113	2694	2819	100
2.6043-2.6973	0.2508	121	0.1991	2717	2838	100
2.6973-2.8053	0.2456	150	0.1995	2675	2825	100
2.8053-2.933	0.2306	137	0.1933	2695	2832	100
2.933-3.0876	0.2362	126	0.1944	2694	2820	100
3.0876-3.281	0.2677	127	0.179	2728	2855	100
3.281-3.5342	0.217	131	0.1731	2701	2832	100
3.5342-3.8897	0.1765	143	0.1616	2721	2864	100
3.8897-4.4522	0.1716	152	0.1451	2718	2870	100
4.4522-5.6078	0.183	137	0.1569	2711	2848	100
5.6078-46.4566	0.2112	166	0.1928	2760	2926	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	0.6638	1.4184	-1.1097	8.2141	0.3826	3.1836	-0.3213	0.1724	0.7703	-0.0262	0.1095	-1.7336	-0.2933	0.3043	0.1619	0.2444	-0.0421	-0.0915	0.2291	0.0051	0.427	27.722	28.8908	-5.7289
2	8.8322	0.3238	-3.0305	9.2111	2.4329	7.4663	-0.1017	0.6796	0.3987	-1.1023	-0.0075	0.5229	-0.1954	0.1605	0.1527	0.2373	-0.0157	-0.037	0.2558	0.0196	0.1658	19.7633	27.2649	-10.3043
3	3.6899	0.2714	1.7145	4.946	0.7848	2.1763	0.0833	0.2198	-0.3693	-0.2079	0.1395	-0.49	0.0793	0.1186	-0.2267	0.2031	0.022	0.0186	0.1996	0.0156	0.1804	22.8453	17.8002	-4.746
4	4.8022	-2.414	2.3495	4.3926	1.9074	7.7736	0.0066	-0.1228	0.0382	0.6995	0.0513	-0.2022	0.3193	-0.1392	-0.0415	0.2441	0.0123	-0.0472	0.1412	0.0115	0.2549	26.1227	18.2608	7.2788
5	3.9503	-3.46	-0.3069	3.904	1.4509	5.5375	-0.0021	-0.1662	-0.4425	0.7367	0.188	-0.3038	0.3978	0.2881	-0.2004	0.3594	0.0464	-0.1221	0.2136	0.0163	0.4385	30.695	15.3534	9.389
6	8.4	0.3349	-1.6359	2.4597	-1.6769	7.1231	0.0293	-0.9049	0.1559	0.7999	0.0907	0.721	-0.0225	-0.5923	-0.0322	0.3628	0.014	0.013	0.383	-0.0904	0.2304	12.0922	28.0944	12.7221
7	8.5081	1.7347	5.2831	4.3894	-1.5244	7.919	-0.2585	-0.3494	0.4009	0.8174	-0.139	-0.7359	-0.8554	0.0653	0.4122	0.4335	-0.004	-0.1375	0.2207	-0.0882	0.4381	26.9379	34.419	9.8414
8	2.942	1.5328	2.6444	4.0323	2.596	7.9605	0.0114	-0.1681	0.1638	0.5009	0.0147	-0.0284	0.0314	0.1393	0.0172	0.2905	0.0526	-0.0207	0.2323	-0.0413	0.2699	17.9635	27.9003	6.6667
9	3.5088	2.0604	-0.0796	7.8919	0.3807	4.6474	-0.1523	-0.1583	0.7974	-0.1757	0.1581	0.7158	-0.5106	-0.3267	-0.0104	0.2727	0.091	-0.077	0.2962	-0.0398	0.4103	9.9844	34.6516	-3.3384
10	3.1004	-2.2742	-0.2683	6.6233	6.2798	9.3624	0.1362	-0.3189	-0.0222	0.3771	-0.0821	0.3516	0.4948	-0.3409	0.0059	0.1672	-0.0659	0.0311	0.2689	0.0198	0.2524	5.0255	16.8395	0.015
11	6.5134	-1.448	-0.6497	6.671	3.7279	9.1776	-0.1787	-0.1211	0.5642	0.6166	0.1014	0.8926	0.8225	-0.8665	0.0349	0.2744	-0.0533	0.0188	0.5748	-0.0777	0.5328	-3.7272	18.5524	-2.8
12	7.1725	-0.6847	1.5042	5.3216	-2.9359	5.7306	0.46	-0.1427	-0.3589	0.1262	-0.3679	0.806	0.3402	-0.602	-0.0376	0.2385	-0.084	-0.0239	0.2844	-0.0758	0.3324	3.2054	15.0715	-6.6168
13	2.2974	-1.6201	2.4992	3.9189	-1.6708	6.7408	0.229	-1.1959	-0.8378	0.7026	-0.0217	0.5197	0.8048	-0.8089	-0.1939	0.7476	-0.1644	0.0436	0.7797	0.2007	0.5367	9.7728	2.3936	18.0578
14	2.6185	-3.4471	0.0139	4.6455	0.0122	0.0094	-0.6034	-0.3336	-1.0428	0.9388	0.0931	0.9538	0.8493	-0.5799	0.4087	0.9507	-0.3705	0.1427	1.3033	0.2066	0.6227	1.3793	-0.3916	19.5548
15	3.8739	-0.8218	2.1727	5.9715	-2.5183	9.319	0.0245	-0.8373	-0.0686	0.9383	-0.274	-0.4793	0.1412	-0.4882	0.1982	0.4518	-0.1512	-0.0105	0.5729	0.078	0.3888	11.3259	7.9196	16.9084
16	5.0957	-0.2329	1.2603	5.4768	-1.5073	2.3707	0.1822	-0.0482	-0.3318	-0.299	0.0432	0.8457	0.511	-0.2804	-0.1549	0.2648	-0.0705	-0.0308	0.2083	0.0397	0.255	-10.4501	37.9752	42.5168
17	0.6249	-1.1111	0.3552	4.6654	-3.2459	4.8029	-0.0084	-0.0115	-0.0358	0.2692	0.2299	0.3308	-0.2283	-0.3273	-0.2688	0.1125	-0.0115	0.005	0.2095	-0.0135	0.2365	-7.5878	48.1408	44.0172
18	5.1162	-2.6711	3.1096	6.3368	0.9112	5.3233	-0.2451	-0.1433	0.4287	0.7598	0.2783	-0.5504	-0.3895	0.0683	-0.0519	0.2706	-0.0012	0.0317	0.1826	-0.0203	0.2498	1.2534	49.2438	55.0593
19	2.4449	-1.0371	1.7637	3.4119	-0.6245	5.6433	0.2439	0.1661	-0.2409	-0.3806	-0.1712	-0.2802	0.7409	0.4157	-0.103	0.2905	0.0716	0.0333	0.2136	0.0236	0.279	5.3352	35.1745	42.6815
20	6.7495	-2.8302	1.1949	3.6482	-1.8692	4.2035	-0.0966	0.5946	0.1459	-0.3196	-0.2779	-0.1533	0.3105	0.5589	0.4022	0.2523	-0.0165	0.0106	0.2771	0.0245	0.214	5.1757	49.7518	25.7867
21	3.0017	1.7012	-1.7023	5.1978	2.6771	4.6469	-0.1155	0.3312	0.0329	-0.0965	-0.1626	0.1009	-0.2091	0.0952	0.2584	0.322	0.0266	-0.0694	0.2915	0.064	0.2054	-1.0108	52.1187	25.7103
22	9.4876	2.1113	3.4236	4.423	2.9927	7.2323	0.0747	0.7896	-0.1898	-0.2241	0.2802	-0.6476	-0.0319	0.8441	-0.3476	0.3873	-0.1388	-0.0866	0.4314	0.0618	0.5301	21.7327	61.8679	39.2554
23	7.7208	3.4121	-4.8815	1.9993	-6.5778	5.354	0.2401	-1.0135	-0.1701	0.9384	-0.5337	-0.2532	-1.203	0.9257	0.2075	0.5906	-0.1984	-0.1098	0.6153	-0.0228	0.5005	13.78	58.2112	53.6023
24	4.1045	1.4756	-1.6945	2.0488	2.5619	8.0201	0.1584	-0.0053	0.3774	-0.2971	0.0111	0.9641	-0.7706	-0.6118	-0.0861	0.5994	-0.1436	-0.1452	0.4079	0.0413	0.6497	13.2342	69.8712	44.6756
25	8.6001	0.6247	-1.6613	8.4434	3.5296	6.7493	-0.0199	0.9844	0.441	-0.197	0.2675	-0.5896	-1.0388	0.3803	-0.2475	0.4115	-0.1786	-0.0399	0.4936	0.1078	0.493	22.0983	68.6559	39.8962
26	7.3651	3.213	6.5308	4.2496	3.2684	7.5199	0.1174	0.1262	0.0901	0.5359	-0.1861	-0.3603	-0.2243	0.3325	0.0497	0.3317	-0.1445	-0.086	0.386	0.0814	0.46	15.5238	59.3214	43.0411
27	8.8144	7.2279	6.6741	5.9162	5.4759	5.0449	0.9891	0.4803	-1.321	1.4541	-0.3287	-0.5608	0.7956	0.8793	-0.8926	0.683	-0.0355	-0.3523	0.6845	0.0801	0.8644	30.5534	57.4178	53.2781

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 (resseq 5:17)	A	5 - 17
2	X-RAY DIFFRACTION	2	chain 'A' and (resseq 18:32)	A	18 - 32
3	X-RAY DIFFRACTION	3	chain 'A' and (resseq 33:75)	A	33 - 75
4	X-RAY DIFFRACTION	4	chain 'A' and (resseq 76:97)	A	76 - 97
5	X-RAY DIFFRACTION	5	chain 'A' and (resseq 98:122)	A	98 - 122
6	X-RAY DIFFRACTION	6	chain 'A' and (resseq 123:140)	A	123 - 140
7	X-RAY DIFFRACTION	7	chain 'A' and (resseq 141:160)	A	141 - 160
8	X-RAY DIFFRACTION	8	chain 'A' and (resseq 161:180)	A	161 - 180
9	X-RAY DIFFRACTION	9	chain 'A' and (resseq 181:201)	A	181 - 201
10	X-RAY DIFFRACTION	10	chain 'A' and (resseq 202:220)	A	202 - 220
11	X-RAY DIFFRACTION	11	chain 'A' and (resseq 221:238)	A	221 - 238
12	X-RAY DIFFRACTION	12	chain 'A' and (resseq 239:261)	A	239 - 261
13	X-RAY DIFFRACTION	13	chain 'B' and (resseq 3:73)	B	3 - 73
14	X-RAY DIFFRACTION	14	chain 'B' and (resseq 74:83)	B	74 - 83
15	X-RAY DIFFRACTION	15	chain 'B' and (resseq 84:120)	B	84 - 120
16	X-RAY DIFFRACTION	16	chain 'C' and (resseq 5:32)	C	5 - 32
17	X-RAY DIFFRACTION	17	chain 'C' and (resseq 33:75)	C	33 - 75
18	X-RAY DIFFRACTION	18	chain 'C' and (resseq 76:122)	C	76 - 122
19	X-RAY DIFFRACTION	19	chain 'C' and (resseq 123:201)	C	123 - 201
20	X-RAY DIFFRACTION	20	chain 'C' and (resseq 202:238)	C	202 - 238
21	X-RAY DIFFRACTION	21	chain 'C' and (resseq 239:262)	C	239 - 262
22	X-RAY DIFFRACTION	22	chain 'D' and (resseq 4:38)	D	4 - 38
23	X-RAY DIFFRACTION	23	chain 'D' and (resseq 39:48)	D	39 - 48
24	X-RAY DIFFRACTION	24	chain 'D' and (resseq 49:64)	D	49 - 64
25	X-RAY DIFFRACTION	25	chain 'D' and (resseq 65:83)	D	65 - 83
26	X-RAY DIFFRACTION	26	chain 'D' and (resseq 84:116)	D	84 - 116
27	X-RAY DIFFRACTION	27	chain 'D' and (resseq 117:125)	D	117 - 125

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