PDB-5tbz: E. Coli RNA Polymerase complexed with NusG

ID or keywords:

Entry

Database: PDB / ID: 5tbz

Title

E. Coli RNA Polymerase complexed with NusG

Components

DNA-directed RNA polymerase subunit alpha
DNA-directed RNA polymerase subunit beta
DNA-directed RNA polymerase subunit beta'
Transcription termination/antitermination protein NusG

Keywords

TRANSCRIPTION/RNA / Transcription elongation / RNA polymerase / NusG / TRANSCRIPTION-RNA complex

Function / homology

Function and homology information

transcription elongation-coupled chromatin remodeling / DNA-directed RNA polymerase complex / regulation of DNA-templated transcription elongation / transcription antitermination / DNA-templated transcription termination / ribonucleoside binding / DNA-directed 5'-3' RNA polymerase activity / DNA-directed RNA polymerase / protein dimerization activity / DNA-templated transcription ...
Similarity search - Function

: / Transcription antitermination protein, NusG / Transcription antitermination protein, NusG, bacteria, conserved site / Transcription termination factor nusG signature. / NusG-like / Transcription termination factor nusG / NusG, N-terminal / In Spt5p, this domain may confer affinity for Spt4p. It possesses a RNP-like fold. / NusG, N-terminal domain superfamily / DNA-directed RNA polymerase, subunit beta-prime, bacterial type ...: / Transcription antitermination protein, NusG / Transcription antitermination protein, NusG, bacteria, conserved site / Transcription termination factor nusG signature. / NusG-like / Transcription termination factor nusG / NusG, N-terminal / In Spt5p, this domain may confer affinity for Spt4p. It possesses a RNP-like fold. / NusG, N-terminal domain superfamily / DNA-directed RNA polymerase, subunit beta-prime, bacterial type / DNA-directed RNA polymerase, beta subunit, external 1 domain superfamily / DNA-directed RNA polymerase, beta subunit, external 1 domain / RNA polymerase beta subunit external 1 domain / RNA polymerase, alpha subunit, C-terminal / Bacterial RNA polymerase, alpha chain C terminal domain / DNA-directed RNA polymerase, alpha subunit / DNA-directed RNA polymerase beta subunit, bacterial-type / RNA polymerase Rpb1, domain 3 superfamily / RNA polymerase Rpb1, clamp domain superfamily / RNA polymerase Rpb2, domain 2 superfamily / RNA polymerase Rpb1, domain 3 / RNA polymerase Rpb1, domain 3 / DNA-directed RNA polymerase, subunit beta-prime / RNA polymerase Rpb1, domain 1 / RNA polymerase Rpb1, domain 1 / DNA-directed RNA polymerase, insert domain / DNA-directed RNA polymerase, RpoA/D/Rpb3-type / RNA polymerase Rpb3/RpoA insert domain / RNA polymerase Rpb3/Rpb11 dimerisation domain / RNA polymerases D / RNA polymerase, alpha subunit / RNA polymerase Rpb1, domain 5 / RNA polymerase Rpb1, domain 4 / RNA polymerase Rpb1, domain 2 / RNA polymerase Rpb1, domain 5 / RNA polymerase Rpb1, domain 4 / RNA polymerase, beta subunit, protrusion / RNA polymerase beta subunit / RNA polymerase, N-terminal / RNA polymerase Rpb1, funnel domain superfamily / RNA polymerase I subunit A N-terminus / DNA-directed RNA polymerase, insert domain superfamily / RNA polymerase, RBP11-like subunit / RNA polymerase Rpb2, domain 2 / RNA polymerase Rpb2, domain 2 / RNA polymerase, beta subunit, conserved site / RNA polymerase Rpb2, domain 7 / RNA polymerase Rpb2, domain 3 / RNA polymerase Rpb2, OB-fold / RNA polymerase Rpb2, domain 7 / RNA polymerase Rpb2, domain 3 / RNA polymerases beta chain signature. / DNA-directed RNA polymerase, subunit 2, hybrid-binding domain / DNA-directed RNA polymerase, subunit 2 / DNA-directed RNA polymerase, subunit 2, hybrid-binding domain superfamily / RNA polymerase Rpb2, domain 6 / KOW (Kyprides, Ouzounis, Woese) motif. / Translation protein SH3-like domain superfamily / KOW motif / KOW / Ribosomal protein L2, domain 2
Similarity search - Domain/homology

Biological species

Escherichia coli O157:H7 (bacteria)

Escherichia coli O45:K1 (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT /

molecular replacement / Resolution: 7 Å

Authors

Liu, B. / Steitz, T.A.

Funding support

United States, 1items

Citation

Journal: Nucleic Acids Res. / Year: 2017
Title: Structural insights into NusG regulating transcription elongation.
Authors: Liu, B. / Steitz, T.A.

History

Deposition	Sep 13, 2016	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Dec 7, 2016	Provider: repository / Type: Initial release
Revision 1.1	Dec 21, 2016	Group: Database references
Revision 1.2	Feb 8, 2017	Group: Database references / Derived calculations
Revision 1.3	Sep 20, 2017	Group: Author supporting evidence / Category: pdbx_audit_support / Item: _pdbx_audit_support.funding_organization
Revision 1.4	Dec 25, 2019	Group: Author supporting evidence / Category: pdbx_audit_support / Item: _pdbx_audit_support.funding_organization
Revision 1.5	Oct 30, 2024	Group: Data collection / Database references ...Data collection / Database references / Refinement description / Structure summary Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_entry_details / pdbx_modification_feature / struct_ncs_dom_lim Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _struct_ncs_dom_lim.beg_auth_comp_id / _struct_ncs_dom_lim.beg_label_asym_id / _struct_ncs_dom_lim.beg_label_comp_id / _struct_ncs_dom_lim.beg_label_seq_id / _struct_ncs_dom_lim.end_auth_comp_id / _struct_ncs_dom_lim.end_label_asym_id / _struct_ncs_dom_lim.end_label_comp_id / _struct_ncs_dom_lim.end_label_seq_id

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	5tbz.cif.gz	2.5 MB	Display	PDBx/mmCIF format
PDB format	pdb5tbz.ent.gz	2.1 MB	Display	PDB format
PDBx/mmJSON format	5tbz.json.gz		Tree view	PDBx/mmJSON format
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Validation report

Summary document	5tbz_validation.pdf.gz	585.3 KB	Display	wwPDB validaton report
Full document	5tbz_full_validation.pdf.gz	865.9 KB	Display
Data in XML	5tbz_validation.xml.gz	224.6 KB	Display
Data in CIF	5tbz_validation.cif.gz	299 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/tb/5tbz ftp://data.pdbj.org/pub/pdb/validation_reports/tb/5tbz	HTTPS FTP

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Related structure data

Similar structure data	5nwt-d 6asx-d 0001 6c6u-d 6jbq-d 7d7c-d 6alg-d 4397 6rin-d 6c6s-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	#253 - Jan 2021 Expressome similarity (18) #40 - Apr 2003 RNA Polymerase similarity (1) #48 - Dec 2003 Catabolite Activator Protein similarity (10) #241 - Jan 2020 Twenty Years of Molecules similarity (1)

Deposited unit

A: DNA-directed RNA polymerase subunit alpha

B: DNA-directed RNA polymerase subunit alpha

C: DNA-directed RNA polymerase subunit beta

D: DNA-directed RNA polymerase subunit beta'

F: DNA-directed RNA polymerase subunit alpha

G: DNA-directed RNA polymerase subunit alpha

H: DNA-directed RNA polymerase subunit beta

I: DNA-directed RNA polymerase subunit beta'

J: Transcription termination/antitermination protein NusG

K: Transcription termination/antitermination protein NusG

761 kDa, 10 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

A: DNA-directed RNA polymerase subunit alpha

B: DNA-directed RNA polymerase subunit alpha

C: DNA-directed RNA polymerase subunit beta

D: DNA-directed RNA polymerase subunit beta'

J: Transcription termination/antitermination protein NusG

defined by author
381 kDa, 5 polymers
Search similar-shape structures of this assembly by Omokage search (details)

2

F: DNA-directed RNA polymerase subunit alpha

G: DNA-directed RNA polymerase subunit alpha

H: DNA-directed RNA polymerase subunit beta

I: DNA-directed RNA polymerase subunit beta'

K: Transcription termination/antitermination protein NusG

defined by author
381 kDa, 5 polymers
Search similar-shape structures of this assembly by Omokage search (details)

Unit cell

Length a, b, c (Å)	248.161, 313.781, 162.791
Angle α, β, γ (deg.)	90.000, 130.230, 90.000
Int Tables number	5
Space group name H-M	C121

Noncrystallographic symmetry (NCS)

NCS domain:
NCS domain segments:

Component-ID: _ / Refine code: _

Dom-ID	Ens-ID	Beg auth comp-ID	Beg label comp-ID	End auth comp-ID	End label comp-ID	Auth asym-ID	Label asym-ID	Auth seq-ID	Label seq-ID
1	1	LYS	LYS	VAL	VAL	A	A	10 - 232	17 - 239
2	1	LYS	LYS	VAL	VAL	B	B	10 - 232	17 - 239
1	2	LYS	LYS	LEU	LEU	A	A	10 - 234	17 - 241
2	2	LYS	LYS	LEU	LEU	F	E	10 - 234	17 - 241
1	3	LYS	LYS	VAL	VAL	A	A	10 - 232	17 - 239
2	3	LYS	LYS	VAL	VAL	G	F	10 - 232	17 - 239
1	4	LYS	LYS	VAL	VAL	B	B	10 - 232	17 - 239
2	4	LYS	LYS	VAL	VAL	F	E	10 - 232	17 - 239
1	5	SER	SER	VAL	VAL	B	B	4 - 232	11 - 239
2	5	SER	SER	VAL	VAL	G	F	4 - 232	11 - 239
1	6	TYR	TYR	ASP	ASP	C	C	3 - 1341	3 - 1341
2	6	TYR	TYR	ASP	ASP	H	G	3 - 1341	3 - 1341
1	7	ALA	ALA	ARG	ARG	D	D	23 - 1369	23 - 1369
2	7	ASN	ASN	ARG	ARG	I	H	45 - 1369	45 - 1369
1	8	LYS	LYS	VAL	VAL	F	E	10 - 232	17 - 239
2	8	LYS	LYS	VAL	VAL	G	F	10 - 232	17 - 239
1	9	ARG	ARG	ALA	ALA	J	I	8 - 181	8 - 181
2	9	ARG	ARG	ALA	ALA	K	J	8 - 181	8 - 181

NCS ensembles :

ID
1
2
3
4
5
6
7
8
9

#1: Protein	DNA-directed RNA polymerase subunit alpha / RNAP subunit alpha / RNA polymerase subunit alpha / Transcriptase subunit alpha Mass: 26899.572 Da / Num. of mol.: 4 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli O157:H7 (bacteria) / Gene: rpoA, Z4665, ECs4160 / Production host: Escherichia coli (E. coli) / References: UniProt: P0A7Z6, DNA-directed RNA polymerase
#2: Protein	DNA-directed RNA polymerase subunit beta / RNAP subunit beta / RNA polymerase subunit beta / Transcriptase subunit beta Mass: 150820.875 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli O45:K1 (strain S88 / ExPEC) (bacteria) Strain: S88 / ExPEC / Gene: rpoB, ECS88_4448 / Production host: Escherichia coli (E. coli) / References: UniProt: B7MIX3, DNA-directed RNA polymerase
#3: Protein	DNA-directed RNA polymerase subunit beta' / RNAP subunit beta' / RNA polymerase subunit beta' / Transcriptase subunit beta' Mass: 155366.781 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli O157:H7 (bacteria) / Gene: rpoC, Z5561, ECs4911 / Production host: Escherichia coli (E. coli) / References: UniProt: P0A8T8, DNA-directed RNA polymerase
#4: Protein	Transcription termination/antitermination protein NusG Mass: 20560.523 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Escherichia coli O157:H7 (bacteria) / Gene: nusG, Z5555, ECs4905 / Production host: Escherichia coli (E. coli) / References: UniProt: P0AFG1
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: 3.18 Å³/Da / Density % sol: 61.31 %
Crystal grow	Temperature: 298 K / Method: evaporation Details: 0.1 M sodium dihydrogen phosphate pH 6.5, 12% (w/v) PEG 8000

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: APS / Beamline: 24-ID-E / Wavelength: 0.97918 Å
Detector	Type: ADSC QUANTUM 315 / Detector: CCD / Date: Jun 16, 2016
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.97918 Å / Relative weight: 1
Reflection	Resolution: 7→162.19 Å / Num. obs: 13735 / % possible obs: 100 % / Redundancy: 4.9 % / Net I/σ(I): 2.6

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Phasing

Phasing	Method: molecular replacement

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Processing

Software

Name	Version	Classification
HKL-2000		data collection
HKL-2000		data reduction
PHASER		phasing
REFMAC	5.8.0155	refinement
PDB_EXTRACT	3.2	data extraction
SCALA		data scaling

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT / Resolution: 7→162.19 Å / Cor.coef. F_o:F_c: 0.824 / Cor.coef. F_o:F_c free: 0.724 / SU ML: 8.849 / Cross valid method: THROUGHOUT / σ(F): 0 / ESU R Free: 5.441
Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT U VALUES : WITH TLS ADDED

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.3946	707	4.9 %	RANDOM
R_work	0.3302	-	-	-
obs	0.3332	13735	95.99 %	-

Solvent computation

Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å

Displacement parameters

B_iso max: 549.92 Å² / B_iso mean: 330.945 Å² / B_iso min: 223.69 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	-3.83 Å²	-0 Å²	-3.47 Å²
2-	-	8.33 Å²	0 Å²
3-	-	-	0.57 Å²

Refinement step

Cycle: final / Resolution: 7→162.19 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	50131	0	0	0	50131
Num. residues	-	-	-	-	6421

Refine LS restraints

Refine-ID	Type	Dev ideal	Dev ideal target	Number
X-RAY DIFFRACTION	r_bond_refined_d	0.009	0.019	50911
X-RAY DIFFRACTION	r_angle_refined_deg	1.439	1.978	68756
X-RAY DIFFRACTION	r_dihedral_angle_1_deg	6.858	5	6402
X-RAY DIFFRACTION	r_dihedral_angle_2_deg	29.027	24.159	2354
X-RAY DIFFRACTION	r_dihedral_angle_3_deg	16.311	15	9341
X-RAY DIFFRACTION	r_dihedral_angle_4_deg	12.495	15	444
X-RAY DIFFRACTION	r_chiral_restr	0.09	0.2	7838
X-RAY DIFFRACTION	r_gen_planes_refined	0.006	0.021	38116
X-RAY DIFFRACTION	r_mcbond_it	3.516	17.284	25665
X-RAY DIFFRACTION	r_mcangle_it	6.548	25.923	32042
X-RAY DIFFRACTION	r_scbond_it	2.39	17.37	25244

Refine LS restraints NCS

Refine-ID: X-RAY DIFFRACTION / Type: interatomic distance / Weight position: 0.05

Ens-ID	Dom-ID	Auth asym-ID	Number	Rms dev position (Å)
1	1	A	10264	0.08
1	2	B	10264	0.08
2	1	A	11750	0.05
2	2	F	11750	0.05
3	1	A	10360	0.08
3	2	G	10360	0.08
4	1	B	10280	0.08
4	2	F	10280	0.08
5	1	B	11106	0.02
5	2	G	11106	0.02
6	1	C	75804	0.04
6	2	H	75804	0.04
7	1	D	71848	0.06
7	2	I	71848	0.06
8	1	F	10374	0.08
8	2	G	10374	0.08
9	1	J	7646	0.13
9	2	K	7646	0.13

LS refinement shell

Resolution: 7→7.181 Å / Total num. of bins used: 20

	R_factor	Num. reflection	% reflection
R_free	0.492	43	-
R_work	0.426	757	-
all	-	800	-
obs	-	-	71.17 %

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	2.6673	0.1654	-0.0145	0.0693	0.0877	1.2435	0.1601	0.1894	0.2444	0.2812	-0.1419	0.0642	0.0635	0.1292	-0.0182	2.006	0.1479	0.1882	1.881	-0.0499	2.0368	310.849	49.0722	177.7547
2	7.3859	1.9611	0.8088	7.9128	2.177	0.6255	0.0513	-0.2121	-0.4383	0.1539	0.1285	0.0189	0.0701	0.0396	-0.1798	1.9847	-0.0824	0.441	1.5918	0.2609	1.5861	305.1544	15.3535	165.0399
3	2.5595	2.4403	2.1227	2.4014	2.0467	1.8855	0.3024	-0.2988	0.1772	0.396	0.0401	0.084	0.026	-0.2264	-0.3425	1.8696	0.275	0.4368	1.6355	0.0506	2.094	318.692	84.9107	184.012
4	2.2632	0.8652	0.8481	1.3985	1.8854	2.7151	-0.0214	0.1615	0.2417	-0.2975	0.0496	0.1968	-0.5387	-0.1426	-0.0282	2.1415	0.2992	0.5752	0.1992	0.3997	1.9402	319.8625	44.0001	137.1122
5	0.2919	0.1715	0.6267	0.2855	0.1359	1.9086	-0.1225	-0.1144	0.2846	0.0059	0.0629	0.2684	-0.1305	-0.1349	0.0596	1.6555	0.3498	0.5482	1.0034	0.1074	2.2294	359.3783	46.169	152.9948
6	0.5391	-0.5575	0.062	0.9213	-0.5847	3.5355	-0.2289	-0.2069	-0.4714	-0.2634	-0.1538	0.4896	-0.5136	-0.4646	0.3826	1.8272	0.2416	0.0893	1.5199	0.0636	2.3603	319.8035	-6.5026	145.992
7	74.3751	17.2776	37.0842	9.9976	17.3928	31.6118	-2.2551	1.805	4.1239	-2.069	0.6552	0.6096	-4.2053	0.6687	1.5999	3.1007	0.8696	0.2335	1.0261	0.7956	2.1142	347.7523	-17.6901	167.9975
8	1.6907	-2.0086	0.239	3.4809	1.4377	3.1894	0.5502	0.162	0.318	-0.0268	0.054	-0.5866	0.6254	0.0251	-0.6042	1.6882	-0.4085	0.3987	1.5965	0.0408	2.1472	333.7791	-0.9043	114.7131
9	5.1622	0.6193	1.3983	1.1668	0.0275	0.4512	-0.1192	0.3108	-0.4976	0.0248	0.3517	-0.1002	0.0599	-0.2341	-0.2325	2.1696	-0.1137	0.396	1.7626	-0.0345	1.7986	353.9476	25.1012	97.9154
10	3.4728	-0.7755	2.8216	0.8143	0.0923	3.1596	0.4674	-0.0642	0.5551	-0.1876	-0.9302	-0.2141	0.6001	-1.1101	0.4628	1.9009	-0.1319	0.6007	1.8246	0.1863	1.9071	362.3298	42.8018	72.7819
11	5.9586	0.6424	3.721	3.1045	-0.8572	2.8478	-0.2169	0.6673	0.072	-0.233	-0.0109	-0.4582	-0.1261	0.4567	0.2278	2.0325	0.1991	0.3979	1.8237	-0.1806	1.8144	377.6049	66.4455	113.8739
12	0.2155	0.244	0.3749	0.3314	0.5789	1.1286	-0.0351	0.3478	-0.2615	0.1034	0.2053	-0.1371	0.1539	-0.1322	-0.1702	2.0913	-0.0408	0.5472	2.04	-0.0713	2.4422	377.3351	17.4585	133.2782
13	1.7372	0.7017	1.3931	3.5368	2.0163	2.3686	0.4496	0.0368	-0.3098	0.3137	-0.0889	0.1739	0.2784	0.2838	-0.3607	1.7347	-0.0627	0.385	1.9605	0.1227	1.7767	351.4289	-56.997	213.3568
14	4.3748	5.4921	2.6142	10.0392	-1.2525	8.4808	-0.2436	0.0188	0.3106	0.1886	0.1842	0.3007	-0.2548	-0.2262	0.0594	1.4221	0.3841	0.3877	1.3854	-0.0541	1.9149	364.83	-23.0273	216.9384
15	0.1805	0.4533	0.2062	4.5893	1.5828	0.625	0.1629	-0.4681	-0.3152	0.2978	-0.2115	-0.0415	-0.0787	-0.3905	0.0485	1.985	-0.2343	0.1607	1.9816	0.2336	2.2347	344.5365	-93.2723	206.4575
16	2.5229	0.8161	0.9501	0.9456	-0.604	1.6084	0.0428	-0.4973	-0.9221	0.0072	-0.1807	-0.6559	0.2875	-0.1652	0.1379	1.9996	0.1899	0.8702	0.137	0.1	2.4872	389.9467	-51.8582	197.4145
17	0.869	-0.0896	0.6195	1.7883	1.3499	1.6254	0.2546	-0.2471	-0.3337	0.1286	-0.1603	0.0605	0.0827	-0.2133	-0.0943	1.7536	-0.0441	0.431	0.8634	0.3959	2.0855	367.93	-54.2191	160.6834
18	7.3314	2.2229	0.3364	0.7616	-0.049	0.4924	0.1127	-0.6317	-0.2732	0.3394	0.0253	-0.285	-0.5545	-0.7368	-0.1381	2.0018	0.3433	0.003	1.4876	-0.1085	1.9325	381.5152	-1.4448	199.1682
19	14.6758	5.6566	17.5168	2.2016	6.7733	21.0566	-0.7807	-0.396	0.1913	-0.3425	-0.0178	0.2988	-1.0537	0.0757	0.7985	2.436	0.3107	0.8781	2.3632	0.9967	2.9614	355.0336	9.9161	174.6446
20	1.8311	0.5854	0.6456	0.2676	-0.0192	1.4596	0.2408	0.1262	0.3786	-0.2144	-0.1106	0.143	0.391	0.0859	-0.1302	1.9871	0.1723	0.3221	1.6064	-0.1765	2.163	409.7556	-7.0939	180.1993
21	0.8703	-0.2312	1.8421	2.7645	0.3919	4.5419	-0.1585	-0.3135	-0.0474	-0.2391	0.2259	0.1799	-0.4819	0.1035	-0.0674	1.6284	-0.0523	0.3821	1.5812	0.0636	2.2012	422.8776	-33.1749	157.5882
22	6.0944	-0.2611	0.998	8.0827	-5.7728	4.2502	0.4368	-1.3952	-0.0647	-0.3992	-0.2777	0.0086	0.1998	0.0038	-0.1591	1.8946	0.2575	0.3506	1.6288	-0.2952	1.6725	446.1938	-50.8306	145.4103
23	4.5224	1.6885	1.085	11.956	7.9583	5.3282	-0.0678	0.4544	1.2014	-0.048	-0.5606	1.1582	0.1018	-0.185	0.6284	2.0032	-0.0273	0.21	1.7672	0.1867	1.9558	404.0063	-73.8214	136.5265
24	2.1216	0.6321	-0.7432	0.2142	-0.1817	0.3838	0.0473	-0.2695	0.4188	0.1048	0.1129	0.2375	-0.1639	0.5574	-0.1602	2.3637	-0.086	0.4845	1.8818	0.0584	2.2578	384.9505	-27.4607	137.9634
25	0.1682	0.3803	0.1839	1.3222	0.5908	0.3718	0.5201	-0.2358	-0.0488	0.4721	-0.4541	0.4153	0.0686	-0.6415	-0.066	2.7931	0.007	-0.1646	2.509	0.106	2.6204	354.6411	-9.0675	124.0726
26	11.747	-7.0561	-0.2329	4.4163	0.6159	1.4344	-0.3128	-1.0904	1.839	0.4133	0.4682	-1.2068	-0.018	-0.4406	-0.1554	2.5458	-0.5138	-0.0476	2.11	0.2781	2.4359	339.8309	-28.5456	140.6877
27	3.2397	-1.0641	3.7809	0.3516	-1.246	4.5866	-0.567	0.0317	-0.1121	0.2225	0.005	0.0622	-0.8755	0.3776	0.562	2.3202	-0.3535	0.0072	2.5673	-0.0304	2.9498	395.1036	3.5911	160.7435
28	0.5106	-1.9714	1.2684	10.9168	-7.2427	4.8158	0.0876	0.4618	-0.7343	-0.1021	0.4773	1.0768	0.023	-0.4479	-0.5649	2.6593	-0.019	0.0936	3.0016	-0.8813	2.934	379.0469	22.1619	178.6544
29	8.2801	-4.0428	-5.6293	2.3451	2.7289	3.9166	0.409	0.2222	-0.1369	-0.1887	-0.3886	-0.7502	0.0361	-0.1102	-0.0204	2.5076	-0.0331	-0.0454	1.8024	0.1749	2.3184	357.432	84.4952	125.718
30	6.2782	3.837	2.4531	4.5595	1.1288	1.0224	-0.3081	-0.0123	0.3708	0.1426	0.2746	0.5841	-0.1948	-0.0869	0.0336	1.954	-0.045	0.2288	2.268	-0.0039	2.1273	370.9243	82.8251	102.1406
31	2.0653	3.0931	-2.2092	7.0755	-4.3963	2.8525	0.3559	0.4538	0.4219	-0.1978	-0.5258	-0.5471	-0.0565	-0.0065	0.1699	1.8904	0.068	0.0403	2.0648	0.1728	2.5637	396.1357	-91.8264	158.4145
32	1.7495	-0.8114	1.618	7.2427	0.2274	1.6432	0.2212	-0.0835	0.6065	1.0372	-0.7853	-0.0024	0.4771	-0.2704	0.5641	2.3189	-0.0977	0.1581	2.4385	-0.1191	2.2195	417.002	-89.5005	141.126
33	4.9433	2.1169	-0.6855	1.0609	0.1805	2.1915	0.0646	0.2132	0.0015	0.0712	-0.1888	0.107	-0.4652	0.0267	0.1242	2.1072	-0.1559	0.0732	1.8228	-0.0111	2.1971	365.8954	-6.8977	157.013

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Auth asym-ID	Auth seq-ID
1	X-RAY DIFFRACTION	1	A	10 - 51
2	X-RAY DIFFRACTION	1	A	179 - 234
3	X-RAY DIFFRACTION	1	B	4 - 51
4	X-RAY DIFFRACTION	1	B	179 - 232
5	X-RAY DIFFRACTION	2	A	52 - 178
6	X-RAY DIFFRACTION	3	B	52 - 178
7	X-RAY DIFFRACTION	4	C	3 - 28
8	X-RAY DIFFRACTION	4	C	146 - 152
9	X-RAY DIFFRACTION	4	C	445 - 455
10	X-RAY DIFFRACTION	4	C	517 - 831
11	X-RAY DIFFRACTION	4	C	1057 - 1241
12	X-RAY DIFFRACTION	4	D	501 - 790
13	X-RAY DIFFRACTION	5	C	1242 - 1320
14	X-RAY DIFFRACTION	5	D	343 - 500
15	X-RAY DIFFRACTION	5	D	791 - 936
16	X-RAY DIFFRACTION	5	D	1132 - 1153
17	X-RAY DIFFRACTION	5	D	1213 - 1317
18	X-RAY DIFFRACTION	5	D	1345 - 1370
19	X-RAY DIFFRACTION	6	C	832 - 891
20	X-RAY DIFFRACTION	6	C	912 - 1056
21	X-RAY DIFFRACTION	7	C	892 - 911
22	X-RAY DIFFRACTION	8	C	29 - 145
23	X-RAY DIFFRACTION	8	C	456 - 516
24	X-RAY DIFFRACTION	9	C	153 - 226
25	X-RAY DIFFRACTION	9	C	337 - 444
26	X-RAY DIFFRACTION	10	C	227 - 336
27	X-RAY DIFFRACTION	11	D	1154 - 1212
28	X-RAY DIFFRACTION	12	C	1321 - 1341
29	X-RAY DIFFRACTION	12	D	23 - 42
30	X-RAY DIFFRACTION	12	D	97 - 342
31	X-RAY DIFFRACTION	12	D	1318 - 1344
32	X-RAY DIFFRACTION	13	F	10 - 51
33	X-RAY DIFFRACTION	13	F	179 - 234
34	X-RAY DIFFRACTION	13	G	4 - 51
35	X-RAY DIFFRACTION	13	G	179 - 232
36	X-RAY DIFFRACTION	14	F	52 - 178
37	X-RAY DIFFRACTION	15	G	52 - 178
38	X-RAY DIFFRACTION	16	H	3 - 28
39	X-RAY DIFFRACTION	16	H	146 - 152
40	X-RAY DIFFRACTION	16	H	445 - 455
41	X-RAY DIFFRACTION	16	H	517 - 831
42	X-RAY DIFFRACTION	16	H	1057 - 1241
43	X-RAY DIFFRACTION	16	I	501 - 790
44	X-RAY DIFFRACTION	17	H	1242 - 1320
45	X-RAY DIFFRACTION	17	I	343 - 500
46	X-RAY DIFFRACTION	17	I	791 - 936
47	X-RAY DIFFRACTION	17	I	1132 - 1153
48	X-RAY DIFFRACTION	17	I	1213 - 1317
49	X-RAY DIFFRACTION	17	I	1345 - 1370
50	X-RAY DIFFRACTION	18	H	832 - 891
51	X-RAY DIFFRACTION	18	H	912 - 1056
52	X-RAY DIFFRACTION	19	H	892 - 911
53	X-RAY DIFFRACTION	20	H	29 - 145
54	X-RAY DIFFRACTION	20	H	456 - 516
55	X-RAY DIFFRACTION	21	H	153 - 226
56	X-RAY DIFFRACTION	21	H	337 - 444
57	X-RAY DIFFRACTION	22	H	227 - 336
58	X-RAY DIFFRACTION	23	I	1154 - 1212
59	X-RAY DIFFRACTION	24	H	1321 - 1341
60	X-RAY DIFFRACTION	24	I	105 - 244
61	X-RAY DIFFRACTION	24	I	264 - 342
62	X-RAY DIFFRACTION	24	I	1318 - 1344
63	X-RAY DIFFRACTION	25	J	8 - 117
64	X-RAY DIFFRACTION	26	J	125 - 181
65	X-RAY DIFFRACTION	27	K	8 - 117
66	X-RAY DIFFRACTION	28	K	125 - 181
67	X-RAY DIFFRACTION	29	D	941 - 1024
68	X-RAY DIFFRACTION	30	D	1025 - 1131
69	X-RAY DIFFRACTION	31	I	941 - 1024
70	X-RAY DIFFRACTION	32	I	1025 - 1131
71	X-RAY DIFFRACTION	33	D	66 - 96
72	X-RAY DIFFRACTION	33	I	41 - 104
73	X-RAY DIFFRACTION	33	I	245 - 263

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