PDB-3klz: Pentameric formate channel with formate bound

ID or keywords:

Entry

Database: PDB / ID: 3klz

Title

Pentameric formate channel with formate bound

Components

Putative formate transporter 1

Keywords

MEMBRANE PROTEIN / channel /

formate /

Structural Genomics / PSI-2 /

Protein Structure Initiative / New York Consortium on Membrane Protein Structure / NYCOMPS

Function / homology

Function and homology information

formate transport / formate transmembrane transporter activity / identical protein binding /

plasma membrane
Similarity search - Function

Biological species

Vibrio cholerae (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

SAD / Resolution: 2.5 Å

Authors

Waight, A.B. / Wang, D.N. / New York Consortium on Membrane Protein Structure (NYCOMPS)

Citation

Journal: Nat.Struct.Mol.Biol. / Year: 2010
Title: Structure and mechanism of a pentameric formate channel
Authors: Waight, A.B. / Love, J. / Wang, D.N.

History

Deposition	Nov 9, 2009	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Dec 15, 2009	Provider: repository / Type: Initial release
Revision 1.1	Jul 13, 2011	Group: Version format compliance
Revision 1.2	Jul 29, 2020	Group: Advisory / Data collection ...Advisory / Data collection / Derived calculations / Structure summary Category: chem_comp / database_PDB_caveat ...chem_comp / database_PDB_caveat / entity / pdbx_chem_comp_identifier / pdbx_entity_nonpoly / struct_site / struct_site_gen Item: _chem_comp.mon_nstd_flag / _chem_comp.name ..._chem_comp.mon_nstd_flag / _chem_comp.name / _chem_comp.type / _entity.pdbx_description / _pdbx_entity_nonpoly.name Description: Carbohydrate remediation / Provider: repository / Type: Remediation
Revision 1.3	Feb 21, 2024	Group: Data collection / Database references / Structure summary Category: chem_comp / chem_comp_atom ...chem_comp / chem_comp_atom / chem_comp_bond / database_2 Item: _chem_comp.pdbx_synonyms / _database_2.pdbx_DOI / _database_2.pdbx_database_accession

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	3klz.cif.gz	512.1 KB	Display	PDBx/mmCIF format
PDB format	pdb3klz.ent.gz	430.3 KB	Display	PDB format
PDBx/mmJSON format	3klz.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/kl/3klz ftp://data.pdbj.org/pub/pdb/validation_reports/kl/3klz	HTTPS FTP

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Related structure data

Related structure data	3klyC C: citing same article (ref.)
Similar structure data	3kly-d 3q7k-2 3q7k-1 3kcu-d 3kcv-2 3nsg-d 4cat-d 3tds-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
Other databases	TargetDB: GO.190

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Links

PDB pages	PDBj / wwPDB / NCBI
Related items in Molecule of the Month	#173 - May 2014 Aquaporin similarity (1)

Deposited unit

A: Putative formate transporter 1

B: Putative formate transporter 1

C: Putative formate transporter 1

D: Putative formate transporter 1

E: Putative formate transporter 1

hetero molecules

159 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)	99.779, 100.456, 192.955
Angle α, β, γ (deg.)	90.00, 90.00, 90.00
Int Tables number	19
Space group name H-M	P2₁2₁2₁

#1: Protein

Putative formate transporter 1

Mass: 30577.186 Da / Num. of mol.: 5
Source method: isolated from a genetically manipulated source
Source: (gene. exp.)

Vibrio cholerae (bacteria) / Gene: VC_1695 / Plasmid: pBAD / Production host:

Escherichia coli (E. coli) / Strain (production host): BL21 / References: UniProt: Q9KRE7

#2: Sugar

ChemComp-BOG / octyl beta-D-glucopyranoside / Beta-Octylglucoside / octyl beta-D-glucoside / octyl D-glucoside / octyl glucoside /

Octyl glucoside

Type: D-saccharide / Mass: 292.369 Da / Num. of mol.: 14
Source method: isolated from a genetically manipulated source
Formula: C₁₄H₂₈O₆ / Comment: detergent*YM

#3: Chemical

...
ChemComp-FMT / FORMIC ACID /

Formic acid

Mass: 46.025 Da / Num. of mol.: 39 / Source method: obtained synthetically / Formula: CH₂O₂

#4: Water

ChemComp-HOH / water /

Water

Mass: 18.015 Da / Num. of mol.: 227 / 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: 3.16 Å³/Da / Density % sol: 61.11 %
Crystal grow	Temperature: 291 K / Method: vapor diffusion, hanging drop / pH: 7.5 Details: 0.02M MOPS, PH 6.8, 29% (W/V) PEG 550MME, 120MM SODIUM FORMATE, VAPOR DIFFUSION, HANGING DROP, TEMPERATURE 291K

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: NSLS / Beamline: X25 / Wavelength: 0.9795
Detector	Type: ADSC / Detector: CCD / Date: Apr 24, 2009
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.9795 Å / Relative weight: 1
Reflection	Resolution: 2.5→50 Å / Num. obs: 62189 / Redundancy: 7.3 % / R_sym value: 0.17 / Net I/σ(I): 14.6

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Processing

Software

Name	Version	Classification
PHENIX	(phenix.refine: 1.5_2)	refinement
HKL-2000		data reduction
SCALEPACK		data scaling
PHENIX		phasing

Refinement

Method to determine structure:

SAD / Resolution: 2.5→48.24 Å / SU ML: 0.31 / σ(F): 0.15 / Phase error: 19.44 / Stereochemistry target values: ML

	R_factor	Num. reflection	% reflection
R_free	0.223	1921	3 %
R_work	0.173	-	-
obs	0.175	62180	94.5 %

Solvent computation

Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å / Solvent model: FLAT BULK SOLVENT MODEL / B_sol: 69.19 Å² / k_sol: 0.31 e/Å³

Displacement parameters

	B_aniso -1	B_aniso -2	B_aniso -3
1-	-1.3689 Å²	0 Å²	-0 Å²
2-	-	4.1167 Å²	-0 Å²
3-	-	-	-2.7478 Å²

Refinement step

Cycle: LAST / Resolution: 2.5→48.24 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	9822	0	397	227	10446

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.008	10416
X-RAY DIFFRACTION	f_angle_d	1.026	14043
X-RAY DIFFRACTION	f_dihedral_angle_d	17.593	3715
X-RAY DIFFRACTION	f_chiral_restr	0.073	1683
X-RAY DIFFRACTION	f_plane_restr	0.004	1643

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 (%)
2.5-2.5625	0.2262	131	0.1727	4140	X-RAY DIFFRACTION	89
2.5625-2.6318	0.2231	126	0.1552	4186	X-RAY DIFFRACTION	90
2.6318-2.7092	0.2248	135	0.146	4285	X-RAY DIFFRACTION	93
2.7092-2.7967	0.2213	134	0.1441	4302	X-RAY DIFFRACTION	93
2.7967-2.8966	0.1952	141	0.1456	4416	X-RAY DIFFRACTION	95
2.8966-3.0126	0.2153	136	0.1401	4460	X-RAY DIFFRACTION	96
3.0126-3.1497	0.2146	138	0.151	4517	X-RAY DIFFRACTION	97
3.1497-3.3157	0.2246	144	0.1478	4535	X-RAY DIFFRACTION	98
3.3157-3.5234	0.1853	143	0.1599	4588	X-RAY DIFFRACTION	98
3.5234-3.7953	0.2354	111	0.1695	3676	X-RAY DIFFRACTION	78
3.7953-4.177	0.2119	141	0.1619	4682	X-RAY DIFFRACTION	99
4.177-4.781	0.1888	145	0.1548	4708	X-RAY DIFFRACTION	99
4.781-6.0217	0.2186	144	0.1826	4744	X-RAY DIFFRACTION	99
6.0217-48.2477	0.2695	152	0.2272	4942	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	0.0864	0.0316	-0.1189	0.1852	-0.0473	0.1721	0.314	0.0987	0.0037	-0.4637	0.978	-0.2384	-0.1989	-0.1107	-0.0009	0.8166	-0.0134	0.2332	1.0034	0.2253	0.4169	74.3274	93.3102	85.1424
2	0.0324	-0.068	0.1283	0.1233	-0.2465	0.4489	0.0362	0.0337	-0.0395	0.097	-0.0791	0.1831	-0.1478	-0.1446	-0	0.252	-0.0147	0.0089	0.2633	0.0475	0.2286	56.7769	77.1804	98.3519
3	0.8699	-0.2412	0.7147	0.6704	0.5279	1.4415	0.15	0.4587	0.207	0.2006	0.0142	0.1361	0.0154	-0.3567	-0.0001	0.1675	0.0199	-0.0009	0.2344	-0.0283	0.2466	56.8025	74.8467	107.1288
4	0.0277	-0.0396	-0.0008	0.1132	0.0952	0.1626	1.0033	-0.4187	0.1954	-0.9758	1.1684	-1.115	-0.4352	1.3633	0.0102	0.7099	-0.4635	-0.0395	0.8643	-0.2719	1.1097	71.0317	93.5744	105.3286
5	0.0237	-0.0493	0.0189	0.1228	-0.0583	0.0343	0.1381	0.1397	0.7862	-0.6745	0.9586	0.4453	0.016	0.5173	0.0081	1.4825	-0.7122	0.5987	1.208	-0.4176	1.7928	75.552	100.7641	102.5024
6	0.045	0.0121	-0.1019	0.1457	-0.0848	0.456	-0.0209	-0.0688	-0.0024	-1.0108	-0.2669	0.0621	-1.3215	2.5326	0.0115	0.7237	-0.4137	0.1755	1.0001	0.0385	0.8801	68.7917	97.9499	96.8131
7	1.3249	-0.7491	0.2593	0.5298	-0.1718	1.8088	0.0109	0.1712	0.0568	-0.0472	-0.1141	0.0751	-0.1591	-0.0687	-0	0.1684	-0.0117	-0.0242	0.2492	0.0734	0.1936	50.5352	82.5766	101.4371
8	3.9625	-5.2478	-3.2971	8.5474	4.7275	3.6711	-0.1319	-1.0535	1.1984	-0.4696	1.188	-1.7002	-0.5834	1.3774	0.2234	0.2727	-0.0762	0.083	0.4413	0.0282	0.4299	75.5271	78.5129	110.3209
9	1.7451	-0.8651	0.006	1.1145	-0.4133	1.6153	0.0938	0.3066	0.1422	-0.0047	-0.0126	0.0583	-0.161	-0.1997	-0	0.1699	-0.0122	0.0008	0.217	0.0707	0.1871	48.7709	82.3435	102.2403
10	2.4618	0.1469	2.0029	0.8441	-0.5275	3.1325	1.4527	1.0992	-0.6071	0.3765	-1.426	-1.3136	0.0742	2.1757	0.005	0.6367	-0.2942	-0.1471	0.7106	0.1548	0.6465	73.9577	94.1324	115.7877
11	2.1909	0.4701	0.369	3.7932	-5.2003	7.6146	-0.1659	-0.499	0.2588	0.3712	0.7015	0.0596	-1.2309	0.2115	0.1908	0.4961	-0.4421	-0.3465	1.0028	-0.0225	1.0922	81.6385	97.417	128.5593
12	0.8167	-0.991	-0.0144	1.2351	0.2382	1.0129	0.0564	-0.3927	0.1122	-0.0593	-0.2459	-0.1632	-0.0771	-0.0119	0	0.183	-0.0241	-0.0246	0.1328	0.0132	0.1893	61.1273	82.1531	124.3157
13	1.1758	-1.1765	-0.6126	3.2651	-0.4173	2.4143	0.0877	-0.0694	0.4227	0.1476	-0.007	0.4789	-0.0474	0.0107	0.0041	0.1374	0.002	-0.0064	0.1093	0.0084	0.0857	59.7496	72.4266	124.3377
14	0.0881	-0.1548	0.0093	0.3204	-0.2058	0.7388	0.4678	-1.3184	-0.4469	1.0391	-0.1572	0.2727	1.3299	0.7133	-0.0323	0.6842	0.1951	-0.1729	0.7593	0.199	1.0368	74.2712	80.5489	134.2738
15	0.419	0.0821	0.0343	0.1725	0.0837	0.0394	0.6575	0.1507	-0.6239	-1.7675	0.5787	-1.4655	-0.5942	-0.6801	-0.0205	1.2594	-0.1498	-0.4143	1.5007	-0.491	1.5109	85.5673	86.6378	139.8587
16	0.3084	0.2229	0.0691	0.2199	0.1127	0.0837	-1.0951	-0.429	0.3725	0.5476	-0.9424	-0.3931	-0.5291	0.4683	0.0141	0.9901	-0.0905	-0.1994	1.26	-0.0646	0.456	76.6802	88.7368	138.5214
17	1.2006	-0.7144	-0.7203	0.6419	-0.1051	1.5441	-0.0892	-0.1149	0.1293	0.1924	0.103	0.0557	-0.2919	-0.0482	0.0004	0.2125	0.0011	-0.0469	0.0788	-0.0543	0.2019	56.6025	81.4912	131.8091
18	0.2937	-0.1929	-0.456	0.9807	-0.0584	1.2963	-0.115	-0.253	-0.7817	-0.0083	-0.2784	-1.4838	-0.1096	1.5911	-0.0901	0.1937	-0.0581	-0.0522	0.4851	0.0496	0.505	79.795	69.0824	124.8353
19	0.7847	-0.2527	-0.4678	0.4022	0.3658	1.4065	-0.0428	-0.0837	0.1117	0.1433	-0.0619	0.1445	-0.137	-0.1087	-0.0205	0.1679	-0.0302	-0.0156	0.0919	-0.054	0.1734	55.0904	80.5827	132.4257
20	0.9117	-0.5591	-0.2792	0.5	0.47	0.6697	0.5125	-0.1248	1.5715	-0.3265	-0.5294	-1.2653	-1.6938	0.3734	0.0346	0.4601	0.0069	-0.0959	0.8588	0.1886	0.5693	83.6679	69.3706	141.14
21	1.2751	0.123	-0.2544	0.0785	-0.0923	0.1195	0.3546	-0.4425	-0.2569	-0.135	0.8221	0.2382	0.1176	0.5875	0.0034	1.0211	0.0955	0.2136	1.4289	-0.2637	1.9004	94.5082	58.4225	147.4215
22	0.692	-0.2759	-0.7918	0.6206	0.6628	2.3973	-0.0003	-0.3709	-0.2794	0.192	0.0271	0.0487	0.1065	0.0869	0.021	0.1091	0.035	0.0125	0.0467	0.0892	0.1013	66.5244	57.5133	132.7958
23	5.4429	-4.0636	-0.3735	3.0572	0.4929	2.0332	0.3314	0.1339	-1.3304	-1.8856	-0.3145	0.1636	1.0387	0.2277	0.0714	1.1342	0.2074	0.4012	1.4307	-0.1186	0.4066	78.8861	48.0648	134.3767
24	0.1358	0.1887	0.0325	0.5221	-0.1036	0.1056	-0.7868	0.1068	-0.5909	0.023	-0.5569	0.0099	0.7073	0.0317	0.0106	0.7132	0.176	-0.3831	2.0747	0.301	1.4724	90.0435	42.6067	134.6276
25	0.0689	0.0219	-0.027	0.008	-0.0086	0.0094	0.1181	0.336	0.0476	0.5197	-0.372	0.5345	-0.7518	-0.7709	0.0082	1.0376	0.0445	-1.0399	1.6506	0.4461	2.6402	91.3043	42.7859	142.7624
26	0.2761	-0.0694	0.0657	0.0185	-0.018	0.0206	0.0623	-0.9173	-0.8851	-1.0566	0.2955	-0.0913	0.3947	0.7384	0.0013	0.71	0.005	-0.1225	0.7554	0.3822	0.9803	83.9177	46.0362	143.1434
27	1.5389	1.1673	-0.5801	0.8545	-0.4335	2.038	-0.0443	-0.1545	-0.196	0.2341	-0.0668	-0.0299	0.1655	0.0896	-0.0003	0.267	0.0451	-0.0031	0.1771	0.0482	0.171	62.5563	52.092	139.4345
28	0.0669	-0.01	0.121	0.3463	0.0008	0.2568	-0.2216	0.2015	-0.3516	-0.3284	-0.1074	-1.0323	0.4189	0.6851	-0.003	0.2382	0.0642	0.0223	0.3612	0.0233	0.379	77.8516	55.8934	119.4446
29	1.9498	-0.3914	-0.3608	1.6188	-1.3139	1.3805	0.1151	-0.2314	0.0007	0.1108	-0.012	0.1173	-0.0748	-0.113	0.0013	0.1635	0.0027	0.0029	0.1194	0.0595	0.1602	60.1483	49.8345	141.1325
30	0.2371	-0.068	-0.0186	0.0223	0.0132	0.0594	-0.0342	-0.6752	-0.934	0.0777	0.7321	-1.1294	0.1376	1.7608	-0.0036	0.6733	0.119	-0.0842	1.1757	0.0593	0.9953	87.2347	36.0638	122.5936
31	0.3652	-0.3707	0.0327	1.029	-0.4101	1.2962	-0.0825	0.2672	-1.0755	-0.3451	-0.1637	0.3215	0.6294	0.1128	-0.0008	0.3649	0.1264	0.1537	0.1524	0.0116	0.3876	69.6596	37.6604	117.3813
32	1.3657	-0.9107	1.795	0.9959	-1.0393	2.4179	0.0368	-1.3319	-0.2096	0.7061	0.1496	1.0368	0.0404	-1.1139	0.0673	0.2646	-0.0454	0.0755	0.3655	-0.0142	0.4074	50.0808	49.7144	112.9883
33	0.3053	0.4169	-0.3878	0.5552	-0.5284	0.494	-0.6912	-0.0993	-1.0282	-0.262	0.376	-0.0669	0.7835	0.2615	0.0012	0.3678	0.0793	0.1261	0.3406	-0.0432	0.5004	71.9018	42.7926	112.3282
34	0.0407	-0.0183	-0.0157	0.0533	-0.0102	0.012	-0.4397	-0.1424	0.3322	-0.849	0.6772	-0.3949	0.1693	0.9418	-0.0042	1.4639	0.4015	0.3825	1.218	-0.1328	0.8726	78.2829	36.9036	103.3524
35	0.0141	-0.0094	-0.0218	0.009	0.0317	0.1135	-0.0797	-0.3969	-0.1828	0.1582	0.2979	0.5972	-0.0244	-0.4898	-0.0043	1.7975	0.5225	0.7788	1.7275	-0.7759	2.049	86.4225	30.7444	97.4558
36	0.0991	0.0575	-0.0993	0.2256	0.0336	0.1418	-1.196	-0.1373	-0.4821	-0.6047	-0.1045	-0.099	-0.0243	0.7744	-0.0132	1.5374	-0.4233	0.5301	1.3355	-1.0887	1.363	80.4491	26.9856	103.9181
37	1.6102	0.5243	-0.5096	0.7688	-0.4258	2.6629	-0.0336	0.1806	-0.4342	-0.0162	-0.0435	0.1626	0.7455	-0.3798	0.0482	0.4298	0.0191	0.0612	0.0164	-0.0443	0.3681	59.8826	34.8279	113.7792
38	0.144	-0.0179	0.0618	0.0272	-0.0484	0.099	0.364	1.2311	0.1871	-1.3574	-0.5067	-1.405	0.0423	1.2499	0.0014	0.473	0.1317	0.156	0.5115	0.0827	0.5164	77.7446	52.0028	102.692
39	1.518	0.3349	-0.0846	0.5539	0.0554	2.1056	-0.0727	0.2078	-0.4297	-0.0519	-0.0089	0.1429	0.756	-0.2818	0.1266	0.3927	0.036	0.1037	0.0588	-0.095	0.3291	58.99	35.185	112.3325
40	0.0269	0.0202	-0.0122	0.0738	-0.0552	0.0421	-0.368	0.0234	-0.9296	-0.9458	-0.5843	-0.7213	1.1743	0.6033	0.0021	0.8697	0.1794	0.1132	1.0514	-0.1366	0.7113	79.5586	42.775	87.0646
41	0.2742	0.2964	-0.009	0.4052	0.1049	0.1566	0.2049	0.5098	0.4696	-0.0339	-0.1219	0.1947	0.0981	-0.3031	-0.0064	1.6777	-0.0913	1.8654	1.0818	-0.3116	2.1899	81.516	48.6927	74.9963
42	0.1399	-0.487	-0.0495	3.5713	0.061	0.0246	0.7867	0.6312	0.2738	-0.6303	-0.4606	-1.0712	0.4608	-0.1202	-0.0175	0.705	0.0058	0.3683	0.8544	-0.1274	0.3505	73.4896	48.9249	80.4802
43	0.1716	0.0783	-0.1736	0.0334	-0.0851	0.1673	0.0879	0.3816	0.3249	-0.3933	0.1153	-0.0734	-0.1143	-0.0512	0.0001	0.3044	-0.0119	0.0135	0.3174	-0.0721	0.2396	57.8689	51.083	96.2023
44	0.4138	-0.2544	0.4279	2.2311	0.243	0.5428	-0.095	0.2989	-0.2927	-0.1672	0.0893	-0.028	0.4088	0.0224	-0.0001	0.2298	-0.0213	0.0017	0.3184	-0.0438	0.2592	57.0983	57.928	100.6345
45	0.0537	0.0373	-0.0195	0.1972	0.1415	0.1625	-0.9785	0.2458	-1.0779	-0.1385	-0.5694	-0.3404	-1.8237	0.4339	-0.0046	0.9795	-0.2861	0.175	1.3701	0.2805	1.4247	74.9701	63.3147	78.9968
46	0.8213	-0.4015	-0.129	0.5096	-0.1819	0.5973	-0.5244	0.5651	1.2513	-1.3973	-1.1195	-2.7887	-0.8714	0.7844	-0.0251	0.8181	-0.1194	0.1189	1.2018	0.1595	0.8221	70.2595	59.9856	73.4564
47	1.1838	0.0939	0.2856	1.682	0.1906	1.854	0.0136	0.4466	-0.1429	-0.2419	-0.0225	0.0976	0.1683	-0.0769	0.0049	0.174	-0.0117	0.0228	0.2446	-0.0949	0.0752	55.9561	56.3512	92.468
48	0.028	0.0082	0.0417	0.0812	-0.0394	0.0918	-0.74	0.1846	-1.481	-0.3606	0.804	-1.079	0.581	0.3822	-0.0023	0.6101	-0.0533	-0.0444	0.8785	-0.1074	0.6597	41.6885	37.9958	89.9048
49	1.8656	-0.4484	-0.5647	1.4563	-0.606	1.5591	0.1662	0.8813	-0.7128	-0.1099	0.0369	0.6406	0.409	-0.6392	0.2183	0.2144	-0.0364	-0.0846	0.3953	-0.0941	-0.0866	46.9413	54.5362	86.1355
50	0.0732	-0.0299	-0.0796	0.0899	0.0815	0.2247	-0.1485	0.8439	-0.8122	-1.4786	0.3297	-0.3539	-0.3372	-0.0764	-0.0029	0.8695	0.0902	0.0549	0.8264	0.2512	0.7811	72.9939	80.301	83.818

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 22:31)	A	22 - 31
2	X-RAY DIFFRACTION	2	(chain A and resid 32:58)	A	32 - 58
3	X-RAY DIFFRACTION	3	(chain A and resid 59:90)	A	59 - 90
4	X-RAY DIFFRACTION	4	(chain A and resid 91:99)	A	91 - 99
5	X-RAY DIFFRACTION	5	(chain A and resid 100:106)	A	100 - 106
6	X-RAY DIFFRACTION	6	(chain A and resid 107:113)	A	107 - 113
7	X-RAY DIFFRACTION	7	(chain A and resid 114:178)	A	114 - 178
8	X-RAY DIFFRACTION	8	(chain A and resid 179:185)	A	179 - 185
9	X-RAY DIFFRACTION	9	(chain A and resid 186:263)	A	186 - 263
10	X-RAY DIFFRACTION	10	(chain A and resid 264:278)	A	264 - 278
11	X-RAY DIFFRACTION	11	(chain B and resid 24:31)	B	24 - 31
12	X-RAY DIFFRACTION	12	(chain B and resid 32:58)	B	32 - 58
13	X-RAY DIFFRACTION	13	(chain B and resid 59:88)	B	59 - 88
14	X-RAY DIFFRACTION	14	(chain B and resid 89:94)	B	89 - 94
15	X-RAY DIFFRACTION	15	(chain B and resid 95:108)	B	95 - 108
16	X-RAY DIFFRACTION	16	(chain B and resid 109:113)	B	109 - 113
17	X-RAY DIFFRACTION	17	(chain B and resid 114:178)	B	114 - 178
18	X-RAY DIFFRACTION	18	(chain B and resid 179:185)	B	179 - 185
19	X-RAY DIFFRACTION	19	(chain B and resid 186:266)	B	186 - 266
20	X-RAY DIFFRACTION	20	(chain B and resid 267:278)	B	267 - 278
21	X-RAY DIFFRACTION	21	(chain C and resid 20:27)	C	20 - 27
22	X-RAY DIFFRACTION	22	(chain C and resid 28:88)	C	28 - 88
23	X-RAY DIFFRACTION	23	(chain C and resid 89:94)	C	89 - 94
24	X-RAY DIFFRACTION	24	(chain C and resid 95:100)	C	95 - 100
25	X-RAY DIFFRACTION	25	(chain C and resid 101:108)	C	101 - 108
26	X-RAY DIFFRACTION	26	(chain C and resid 109:113)	C	109 - 113
27	X-RAY DIFFRACTION	27	(chain C and resid 114:178)	C	114 - 178
28	X-RAY DIFFRACTION	28	(chain C and resid 179:194)	C	179 - 194
29	X-RAY DIFFRACTION	29	(chain C and resid 195:270)	C	195 - 270
30	X-RAY DIFFRACTION	30	(chain C and resid 271:279)	C	271 - 279
31	X-RAY DIFFRACTION	31	(chain D and resid 27:58)	D	27 - 58
32	X-RAY DIFFRACTION	32	(chain D and resid 59:72)	D	59 - 72
33	X-RAY DIFFRACTION	33	(chain D and resid 73:90)	D	73 - 90
34	X-RAY DIFFRACTION	34	(chain D and resid 91:96)	D	91 - 96
35	X-RAY DIFFRACTION	35	(chain D and resid 97:106)	D	97 - 106
36	X-RAY DIFFRACTION	36	(chain D and resid 107:113)	D	107 - 113
37	X-RAY DIFFRACTION	37	(chain D and resid 114:178)	D	114 - 178
38	X-RAY DIFFRACTION	38	(chain D and resid 179:185)	D	179 - 185
39	X-RAY DIFFRACTION	39	(chain D and resid 186:271)	D	186 - 271
40	X-RAY DIFFRACTION	40	(chain D and resid 272:278)	D	272 - 278
41	X-RAY DIFFRACTION	41	(chain E and resid 23:28)	E	23 - 28
42	X-RAY DIFFRACTION	42	(chain E and resid 29:34)	E	29 - 34
43	X-RAY DIFFRACTION	43	(chain E and resid 35:58)	E	35 - 58
44	X-RAY DIFFRACTION	44	(chain E and resid 59:88)	E	59 - 88
45	X-RAY DIFFRACTION	45	(chain E and resid 89:105)	E	89 - 105
46	X-RAY DIFFRACTION	46	(chain E and resid 106:113)	E	106 - 113
47	X-RAY DIFFRACTION	47	(chain E and resid 114:222)	E	114 - 222
48	X-RAY DIFFRACTION	48	(chain E and resid 223:228)	E	223 - 228
49	X-RAY DIFFRACTION	49	(chain E and resid 229:270)	E	229 - 270
50	X-RAY DIFFRACTION	50	(chain E and resid 271:279)	E	271 - 279

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