PDB-4un5: Crystal structure of Cas9 bound to PAM-containing DNA target cont...

ID or keywords:

Entry

Database: PDB / ID: 4un5

Title

Crystal structure of Cas9 bound to PAM-containing DNA target containing mismatches at positions 1-3

Components

(TARGET DNA STRAND ...) x 2
CRISPR-ASSOCIATED ENDONUCLEASE CAS9/CSN1
NON-TARGET DNA STRAND
SGRNA

Keywords

HYDROLASE/DNA/RNA / HYDROLASE-DNA-RNA COMPLEX / GENOME EDITING / RNP / PROTEIN-RNA COMPLEX

Function / homology

Function and homology information

maintenance of CRISPR repeat elements / 3'-5' exonuclease activity / DNA endonuclease activity / defense response to virus / Hydrolases; Acting on ester bonds / DNA binding / RNA binding / metal ion binding
Similarity search - Function

Biological species

STREPTOCOCCUS PYOGENES (bacteria)
SYNTHETIC CONSTRUCT (others)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 2.4 Å

Authors

Anders, C. / Niewoehner, O. / Duerst, A. / Jinek, M.

Citation

Journal: Nature / Year: 2014
Title: Structural Basis of Pam-Dependent Target DNA Recognition by the Cas9 Endonuclease
Authors: Anders, C. / Niewoehner, O. / Duerst, A. / Jinek, M.

History

Deposition	May 25, 2014	Deposition site: PDBE / Processing site: PDBE
Revision 1.0	Jul 23, 2014	Provider: repository / Type: Initial release
Revision 1.1	Aug 13, 2014	Group: Database references
Revision 1.2	Oct 1, 2014	Group: Database references
Revision 1.3	Jan 10, 2024	Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Other / Refinement description Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_database_status / 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_database_status.status_code_sf / _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.ptnr2_auth_seq_id / _pdbx_struct_conn_angle.ptnr2_label_asym_id / _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.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	4un5.cif.gz	677.6 KB	Display	PDBx/mmCIF format
PDB format	pdb4un5.ent.gz	549.3 KB	Display	PDB format
PDBx/mmJSON format	4un5.json.gz		Tree view	PDBx/mmJSON format
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Validation report

Summary document	4un5_validation.pdf.gz	487.1 KB	Display	wwPDB validaton report
Full document	4un5_full_validation.pdf.gz	511.1 KB	Display
Data in XML	4un5_validation.xml.gz	56.9 KB	Display
Data in CIF	4un5_validation.cif.gz	83.8 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/un/4un5 ftp://data.pdbj.org/pub/pdb/validation_reports/un/4un5	HTTPS FTP

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Related structure data

Related structure data	4un3SC 4un4C S: Starting model for refinement C: citing same article (ref.)
Similar structure data	5fw2-d 5fq5-d 5b2s-d 6k57-d 6k4p-d 6k4u-d 6k4q-d 5fw3-d 5b2r-d 5fw1-d 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	#181 - Jan 2015 Cascade and CRISPR similarity (14) #253 - Jan 2021 Expressome similarity (2) #121 - Jan 2010 70S Ribosomes similarity (1) #130 - Oct 2010 Riboswitches similarity (1) #16 - Apr 2001 Aminoacyl-tRNA Synthetases similarity (1) #67 - Jul 2005 TATA-Binding Protein similarity (1) #157 - Jan 2013 Transfer-Messenger RNA similarity (1) #168 - Dec 2013 DNA Helicase similarity (1) #255 - Mar 2021 Cisplatin and DNA similarity (1) #87 - Mar 2007 Zinc Fingers similarity (2) #91 - Jul 2007 Thymine Dimers similarity (1) #229 - Jan 2019 Fluorescent RNA Aptamers similarity (1) #260 - Aug 2021 Ribonuclease P similarity (1) #122 - Feb 2010 Enhanceosome similarity (1) #172 - Apr 2014 RecA and Rad51 similarity (1) #227 - Nov 2018 Telomerase similarity (2) #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) #112 - Apr 2009 Oct and Sox Transcription Factors similarity (1) #135 - Mar 2011 Integrase similarity (1) #150 - Jun 2012 Sliding Clamps similarity (1) #180 - Dec 2014 TAL Effectors similarity (1) #48 - Dec 2003 Catabolite Activator Protein similarity (1) #84 - Dec 2006 Transposase similarity (1) #10 - Oct 2000 Ribosome similarity (1) #210 - Jun 2017 Adenine Riboswitch in Action similarity (1) #139 - Jul 2011 DNA Methyltransferase similarity (1) #155 - Nov 2012 Vitamin D Receptor similarity (1) #3 - Mar 2000 DNA Polymerase similarity (1) #40 - Apr 2003 RNA Polymerase similarity (1) #73 - Jan 2006 Topoisomerase 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) #119 - Nov 2009 Designed DNA Crystal similarity (1) #125 - May 2010 Parvoviruses similarity (1) #131 - Nov 2010 Inteins similarity (1) #160 - Apr 2013 Actinomycin similarity (1) #190 - Oct 2015 Two-component Systems similarity (1) #23 - Nov 2001 DNA similarity (1) #240 - Dec 2019 Hypoxia-Inducible Factors similarity (1) #257 - May 2021 Fetal Hemoglobin similarity (1) #258 - Jun 2021 Glucocorticoid Receptor and Dexamethasone similarity (1) #31 - Jul 2002 p53 Tumor Suppressor similarity (1) #33 - Sep 2002 HIV Reverse Transcriptase similarity (1) #39 - Mar 2003 lac Repressor similarity (1) #45 - Sep 2003 Estrogen Receptor similarity (1) #55 - Jul 2004 DNA Ligase similarity (1) #7 - Jul 2000 Nucleosome similarity (1) #8 - Aug 2000 Restriction Enzymes similarity (1) #92 - Aug 2007 Anabolic Steroids 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) #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 (2)

PDB pages

PDBj /

wwPDB /

NCBI

Related items in Molecule of the Month

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Deposited unit

A: SGRNA

B: CRISPR-ASSOCIATED ENDONUCLEASE CAS9/CSN1

C: TARGET DNA STRAND PROXIMAL FRAGMENT

D: NON-TARGET DNA STRAND

E: TARGET DNA STRAND DISTAL FRAGMENT

hetero molecules

198 kDa, 5 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)	180.182, 68.072, 190.261
Angle α, β, γ (deg.)	90.00, 111.37, 90.00
Int Tables number	5
Space group name H-M	C121

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TARGET DNA STRAND ... , 2 types, 2 molecules CE

#3: DNA chain	TARGET DNA STRAND PROXIMAL FRAGMENT Mass: 3295.203 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) SYNTHETIC CONSTRUCT (others)
#5: DNA chain	TARGET DNA STRAND DISTAL FRAGMENT Mass: 5215.419 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) SYNTHETIC CONSTRUCT (others)

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RNA chain / Protein / DNA chain , 3 types, 3 molecules ABD

#1: RNA chain	SGRNA Mass: 26788.984 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) SYNTHETIC CONSTRUCT (others)
#2: Protein	CRISPR-ASSOCIATED ENDONUCLEASE CAS9/CSN1 Mass: 158875.031 Da / Num. of mol.: 1 / Mutation: YES Source method: isolated from a genetically manipulated source Source: (gene. exp.) STREPTOCOCCUS PYOGENES (bacteria) / Strain: M1 / Plasmid: PEC-K-MBP / Production host: ESCHERICHIA COLI (E. coli) / Strain (production host): BL21(DE3) / Variant (production host): ROSETTA 2 References: UniProt: Q99ZW2, Hydrolases; Acting on ester bonds
#4: DNA chain	NON-TARGET DNA STRAND Mass: 3410.229 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) SYNTHETIC CONSTRUCT (others)

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Non-polymers , 2 types, 780 molecules

#6: Chemical	ChemComp-MG / MAGNESIUM ION Mass: 24.305 Da / Num. of mol.: 8 / Source method: obtained synthetically / Formula: Mg
#7: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 772 / Source method: isolated from a natural source / Formula: H₂O

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Details

Sequence details	N-TERMINAL GAAS SEQUENCE IS DERIVED FROM EXPRESSION PLASMID. H840A MUTATION WAS INTRODUCED TO ...N-TERMINAL GAAS SEQUENCE IS DERIVED FROM EXPRESSION PLASMID. H840A MUTATION WAS INTRODUCED TO INACTIVATE THE HNH DOMAIN. D10A MUTATION WAS INTRODUCED TO INACTIVATE THE RUVC DOMAIN.

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Experiment

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

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Sample preparation

Crystal	Density Matthews: 2.68 Å³/Da / Density % sol: 54.1 % / Description: NONE
Crystal grow	pH: 8.5 Details: 0.1 M TRIS-ACETATE PH 8.5, 0.3 M KSCN, 15% PEG (W/V) 3350

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: SLS / Beamline: X06DA / Wavelength: 1
Detector	Type: DECTRIS PILATUS / Detector: PIXEL / Date: May 10, 2014
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 1 Å / Relative weight: 1
Reflection	Resolution: 2.4→48.35 Å / Num. obs: 164018 / % possible obs: 99.9 % / Observed criterion σ(I): 2 / Redundancy: 6.6 % / R_merge(I) obs: 0.09 / Net I/σ(I): 15.3
Reflection shell	Resolution: 2.4→2.49 Å / Redundancy: 6.7 % / R_merge(I) obs: 0.37 / Mean I/σ(I) obs: 4 / % possible all: 100

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Processing

Software

Name	Version	Classification
PHENIX	(PHENIX.REFINE: 1.8.2_1309)	refinement
XDS		data reduction
SCALA		data scaling
PHASER		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: PDB ENTRY 4UN3

4un3

Resolution: 2.4→48.349 Å / SU ML: 0.32 / σ(F): 1.08 / Phase error: 26.2 / Stereochemistry target values: ML

	R_factor	Num. reflection	% reflection
R_free	0.2465	8212	5 %
R_work	0.2149	-	-
obs	0.2165	84384	99.65 %

Solvent computation

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

Refinement step

Cycle: LAST / Resolution: 2.4→48.349 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	10716	2447	8	772	13943

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.011	13657
X-RAY DIFFRACTION	f_angle_d	0.686	18911
X-RAY DIFFRACTION	f_dihedral_angle_d	16.395	5521
X-RAY DIFFRACTION	f_chiral_restr	0.048	2158
X-RAY DIFFRACTION	f_plane_restr	0.002	1991

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 (%)
2.4-2.4273	0.3148	273	0.2694	5194	X-RAY DIFFRACTION	100
2.4273-2.4558	0.3234	273	0.2832	5139	X-RAY DIFFRACTION	100
2.4558-2.4858	0.3656	267	0.2726	5149	X-RAY DIFFRACTION	99
2.4858-2.5172	0.2959	284	0.2661	5331	X-RAY DIFFRACTION	100
2.5172-2.5504	0.316	269	0.2636	5116	X-RAY DIFFRACTION	100
2.5504-2.5853	0.3327	276	0.2704	5192	X-RAY DIFFRACTION	100
2.5853-2.6222	0.3553	278	0.2879	5286	X-RAY DIFFRACTION	100
2.6222-2.6614	0.3415	287	0.2788	5133	X-RAY DIFFRACTION	100
2.6614-2.7029	0.3263	262	0.2635	5209	X-RAY DIFFRACTION	100
2.7029-2.7473	0.3127	261	0.2618	5280	X-RAY DIFFRACTION	100
2.7473-2.7946	0.3275	275	0.269	5105	X-RAY DIFFRACTION	100
2.7946-2.8454	0.3127	284	0.2583	5272	X-RAY DIFFRACTION	100
2.8454-2.9002	0.2936	291	0.2536	5201	X-RAY DIFFRACTION	100
2.9002-2.9593	0.2991	268	0.2598	5244	X-RAY DIFFRACTION	100
2.9593-3.0237	0.3159	269	0.2564	5147	X-RAY DIFFRACTION	100
3.0237-3.094	0.2762	280	0.2526	5266	X-RAY DIFFRACTION	100
3.094-3.1714	0.2679	274	0.249	5119	X-RAY DIFFRACTION	100
3.1714-3.2571	0.2647	276	0.2385	5239	X-RAY DIFFRACTION	100
3.2571-3.3529	0.2663	274	0.2324	5138	X-RAY DIFFRACTION	100
3.3529-3.4611	0.2719	266	0.2241	5219	X-RAY DIFFRACTION	100
3.4611-3.5848	0.2508	286	0.2211	5276	X-RAY DIFFRACTION	100
3.5848-3.7283	0.2306	272	0.2083	5132	X-RAY DIFFRACTION	99
3.7283-3.8979	0.2063	261	0.1919	5156	X-RAY DIFFRACTION	99
3.8979-4.1033	0.1984	275	0.1825	5143	X-RAY DIFFRACTION	99
4.1033-4.3602	0.184	266	0.1729	5179	X-RAY DIFFRACTION	99
4.3602-4.6966	0.2008	274	0.1684	5182	X-RAY DIFFRACTION	99
4.6966-5.1688	0.1906	275	0.1642	5170	X-RAY DIFFRACTION	100
5.1688-5.9155	0.2437	273	0.1777	5213	X-RAY DIFFRACTION	99
5.9155-7.4486	0.1916	273	0.1912	5200	X-RAY DIFFRACTION	100
7.4486-48.3588	0.1758	270	0.1695	5176	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	0.0133	-0.0019	0.0238	0.0318	-0.0096	0.0849	0.023	0.0927	0.0089	0.001	-0.001	0.0059	0.049	0.0897	0.075	-0.1803	-0.1331	0.0183	0.0784	-0.0056	0.0334	109.8436	58.5479	208.7076
2	0.0191	0.0204	-0.001	0.0157	-0.0142	0.0064	-0.064	0.0263	-0.0218	0.018	-0.003	0.0377	-0.0513	-0.0139	0	0.235	0.0267	0.0032	0.1785	-0.0597	0.1384	137.5355	50.0062	242.307
3	0.0691	-0.0563	0.057	0.122	0.0109	0.233	0.029	-0.0416	-0.0263	0.0802	0.0495	-0.0481	0.0459	0.1735	0.2015	0.0868	-0.0068	-0.0284	0.0647	-0.0065	0.0945	124.5753	57.865	226.5669
4	0.0288	0.0085	0.0197	0.0141	0.0069	0.0619	-0.0102	-0.018	-0.0131	0.0987	0.0579	-0.0197	-0.0959	0.0034	0.0187	0.1553	0.0285	-0.0113	0.0919	0.0112	0.1322	109.9055	72.1481	258.1484
5	0.0305	-0.0088	0.0003	0.0304	0.0156	0.0987	-0.0063	0.0189	-0.0355	0.0419	0.0237	-0.0529	0.0986	0.0876	-0.0107	0.1585	0.004	-0.0058	0.1175	-0.0315	0.1817	101.83	38.8388	241.51
6	0.1308	0.0499	-0.0252	0.058	0.0407	0.0837	-0.0929	0.1242	-0.0813	0.1405	0.0598	0.0587	0.2882	-0.0467	0.0684	0.0259	-0.2698	0.063	-0.0977	0.007	0.1557	80.765	39.5106	220.4812
7	0.0431	-0.0133	0.0435	0.0127	-0.0109	0.0301	0.06	0.011	0.0221	0.0255	0.0138	-0.0018	0.0585	0.0517	0	0.1402	-0.0102	0.03	0.1732	-0.0406	0.144	114.3249	53.9674	220.102
8	0.0007	-0.0008	0	0.0016	0.0012	0.001	0.0087	0.0045	0.006	-0.0001	0.0077	0.0128	0.0008	-0.0022	0	0.6231	0.0577	-0.0627	0.5939	-0.0805	0.46	132.0784	31.9414	179.2304
9	0.0529	0.0187	-0.036	0.0193	0.0231	0.1059	0.0288	0.0575	0.0573	-0.0498	0.0577	0.007	0.0239	0.0571	0.0121	0.1036	-0.0065	-0.0007	0.1245	-0.0079	0.1246	110.0059	60.9197	207.1628
10	0.0007	0.001	0.0008	0.0002	0.0001	0	0.026	-0.0004	0.0024	0.0041	0.0201	-0.0003	-0.0161	0.0082	0	0.3776	-0.0396	0.0259	0.3425	0.0447	0.3964	71.2809	66.3353	211.2261
11	0.0022	-0.0027	0.0001	0.0025	0.0004	-0.0002	-0.0292	0.009	0.0039	0.0072	-0.0101	-0.0258	0.0087	-0.0258	0	0.3292	-0.0527	-0.0239	0.3146	-0.0527	0.3429	98.8101	32.7607	200.4888
12	0.0049	0.0031	0.0004	0.0047	-0.0004	0.0005	0.0109	0.01	-0.0361	-0.0047	0.0177	-0.0027	0.0077	0.0038	0	0.2896	-0.0738	0.0184	0.2482	-0.1062	0.3076	98.6479	36.3316	201.4157
13	0.0009	0.0007	0.0004	0.0007	0.0001	0.0002	-0.0045	-0.0171	0.0028	0.0036	-0.0089	0.0037	-0.0045	-0.0014	0	0.1826	0.0108	0.0126	0.1889	-0.0052	0.1522	115.5949	58.7585	230.0901
14	0.0009	-0.0005	-0.0003	0.0009	0	0.0007	0.0168	0.0007	-0.0114	0.0019	0.0117	0.0126	0.0075	0.0117	0	0.2278	-0.0624	0.0231	0.2673	-0.0161	0.2799	99.1735	59.0594	240.4546
15	0.0005	0.001	0.0009	0.0023	-0.0002	0.0006	0.0038	-0.0112	0.009	0.0017	0.0055	0.0088	0.0122	-0.0146	0	0.2693	-0.0431	0.0296	0.2339	0.0543	0.2469	95.5321	55.2063	258.1355

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details
1	X-RAY DIFFRACTION	1	CHAIN 'B' AND (RESID 4 THROUGH 163 )
2	X-RAY DIFFRACTION	2	CHAIN 'B' AND (RESID 164 THROUGH 284 )
3	X-RAY DIFFRACTION	3	CHAIN 'B' AND (RESID 285 THROUGH 551 )
4	X-RAY DIFFRACTION	4	CHAIN 'B' AND (RESID 552 THROUGH 711 )
5	X-RAY DIFFRACTION	5	CHAIN 'B' AND (RESID 712 THROUGH 909 )
6	X-RAY DIFFRACTION	6	CHAIN 'B' AND (RESID 910 THROUGH 1364 )
7	X-RAY DIFFRACTION	7	CHAIN 'A' AND (RESID 0 THROUGH 32 )
8	X-RAY DIFFRACTION	8	CHAIN 'A' AND (RESID 33 THROUGH 40 )
9	X-RAY DIFFRACTION	9	CHAIN 'A' AND (RESID 41 THROUGH 68 )
10	X-RAY DIFFRACTION	10	CHAIN 'A' AND (RESID 69 THROUGH 81 )
11	X-RAY DIFFRACTION	11	CHAIN 'C' AND (RESID 1 THROUGH 9 )
12	X-RAY DIFFRACTION	12	CHAIN 'D' AND (RESID 3 THROUGH 12 )
13	X-RAY DIFFRACTION	13	CHAIN 'E' AND (RESID 12 THROUGH 16 )
14	X-RAY DIFFRACTION	14	CHAIN 'E' AND (RESID 17 THROUGH 21 )
15	X-RAY DIFFRACTION	15	CHAIN 'E' AND (RESID 22 THROUGH 28 )

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