PDB-3zsf: Crystal structure of the L-cystine solute receptor of Neisseria g...

ID or keywords:

Entry

Database: PDB / ID: 3zsf

Title

Crystal structure of the L-cystine solute receptor of Neisseria gonorrhoeae in the unliganded open conformation

Components

ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

ATP-binding cassette transporter

Keywords

TRANSPORT PROTEIN

Function / homology

Function and homology information

Solute-binding protein family 3, conserved site / Bacterial extracellular solute-binding proteins, family 3 signature. / Bacterial periplasmic substrate-binding proteins / Bacterial extracellular solute-binding proteins, family 3 / Solute-binding protein family 3/N-terminal domain of MltF / Periplasmic binding protein-like II / D-Maltodextrin-Binding Protein; domain 2 / Prokaryotic membrane lipoprotein lipid attachment site profile. / 3-Layer(aba) Sandwich / Alpha Beta
Similarity search - Domain/homology

Biological species

NEISSERIA GONORRHOEAE (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 2.32 Å

Authors

Bulut, H. / Moniot, S. / Scheffel, F. / Gathmann, S. / Licht, A. / Saenger, W. / Schneider, E.

Citation

Journal: J.Mol.Biol. / Year: 2012
Title: Crystal Structures of Two Solute Receptors for L-Cystine and L-Cysteine, Respectively, of the Human Pathogen Neisseria Gonorrhoeae.
Authors: Bulut, H. / Moniot, S. / Licht, A. / Scheffel, F. / Gathmann, S. / Saenger, W. / Schneider, E.

History

Deposition	Jun 27, 2011	Deposition site: PDBE / Processing site: PDBE
Revision 1.0	Dec 14, 2011	Provider: repository / Type: Initial release
Revision 1.1	Jan 25, 2012	Group: Other
Revision 1.2	Dec 20, 2023	Group: Data collection / Database references ...Data collection / Database references / 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 / struct_ncs_dom_lim 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 / _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	3zsf.cif.gz	710.4 KB	Display	PDBx/mmCIF format
PDB format	pdb3zsf.ent.gz	590.7 KB	Display	PDB format
PDBx/mmJSON format	3zsf.json.gz		Tree view	PDBx/mmJSON format
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Validation report

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

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Related structure data

Related structure data	2yjpC 2ylnC 2ieeS C: citing same article (ref.) S: Starting model for refinement
Similar structure data	3dv8-d 4led-2 4cw7-4 4bpu-3 3cvg-4 2k5x-d 5doi-2 4xpm-d 4y18-3 4wtz-6 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) 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 - HomologyF&H Search

Related structure data

2yjpC

2ylnC

2ieeS

C: citing same article (ref.)

S: Starting model for refinement

Similar structure data

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Links

PDB pages	PDBj / wwPDB / NCBI
Related items in Molecule of the Month	#261 - Sep 2021 DNA-Sequencing Nanopores similarity (1) #22 - Oct 2001 Photosystem I similarity (1) #262 - Oct 2021 Fifty Years of Open Access to PDB Structures similarity (1) #29 - May 2002 Penicillin-binding Proteins similarity (1) #95 - Nov 2007 Multidrug Resistance Transporters similarity (1)

Deposited unit

A: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

B: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

C: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

D: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

E: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

F: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

G: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

H: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

241 kDa, 8 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

A: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

defined by author&software
30.1 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

2

B: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

defined by author&software
30.1 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

3

C: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

defined by author&software
30.1 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

4

D: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

defined by author&software
30.1 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

5

E: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

defined by author&software
30.1 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

6

F: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

defined by author&software
30.1 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

7

G: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

defined by author&software
30.1 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

8

H: ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID

defined by author&software
30.1 kDa, 1 polymers
Search similar-shape structures of this assembly by Omokage search (details)

Unit cell

Length a, b, c (Å)	74.090, 99.830, 128.830
Angle α, β, γ (deg.)	90.00, 91.50, 90.00
Int Tables number	4
Space group name H-M	P12₁1

Noncrystallographic symmetry (NCS)

NCS domain:

ID	Ens-ID	Details
1	1	A
2	1	C
3	1	E
4	1	G
1	2	B
2	2	D
3	2	F
4	2	H

NCS domain segments:

Component-ID: 1 / Beg auth comp-ID: GLY / Beg label comp-ID: GLY / End auth comp-ID: GLN / End label comp-ID: GLN / Auth seq-ID: 39 - 275 / Label seq-ID: 47 - 283

Dom-ID	Ens-ID	Refine code	Auth asym-ID	Label asym-ID
1	1	2	A	A
2	1	2	C	C
3	1	2	E	E
4	1	2	G	G
1	2	1	B	B
2	2	1	D	D
3	2	1	F	F
4	2	1	H	H

NCS ensembles :

ID
1
2

#1: Protein	ABC TRANSPORTER, PERIPLASMIC BINDING PROTEIN, AMINO ACID / ATP-binding cassette transporter / SOLUTE RECEPTOR FOR L-CYSTINE Mass: 30067.436 Da / Num. of mol.: 8 / Mutation: YES Source method: isolated from a genetically manipulated source Source: (gene. exp.) NEISSERIA GONORRHOEAE (bacteria) / Strain: FA1090 / Production host: ESCHERICHIA COLI (E. coli) / Strain (production host): BL21(DE3) / Variant (production host): PLYSS / References: UniProt: Q5F9M1
#2: Water	ChemComp-HOH / water / Water Mass: 18.015 Da / Num. of mol.: 579 / Source method: isolated from a natural source / Formula: H₂O
Compound details	ENGINEERED RESIDUE IN CHAIN A, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN B, CYS 19 TO ALA ...ENGINEERED RESIDUE IN CHAIN A, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN B, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN C, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN D, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN E, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN F, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN G, CYS 19 TO ALA ENGINEERED RESIDUE IN CHAIN H, CYS 19 TO ALA
Sequence details	N-TERMINAL HIS-TAG CONSTRUCT WITH ENTEROKINASE CLEAVAGE SITE AND C19A MUTATION.

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Experiment

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

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Sample preparation

Crystal	Density Matthews: 2.31 Å³/Da / Density % sol: 46.4 % / Description: NONE
Crystal grow	pH: 3.5 / Details: 20-30% PEG 3350, 100 MM NA-CITRATE, PH 3.5

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: BESSY / Beamline: 14.1 / Wavelength: 0.91841
Detector	Type: MARRESEARCH / Detector: CCD
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.91841 Å / Relative weight: 1
Reflection	Resolution: 2.32→48 Å / Num. obs: 81031 / % possible obs: 99.7 % / Observed criterion σ(I): -3 / Redundancy: 3.8 % / B_iso Wilson estimate: 40.3 Å² / R_merge(I) obs: 0.11 / Net I/σ(I): 9.86
Reflection shell	Resolution: 2.32→2.38 Å / Redundancy: 3.6 % / R_merge(I) obs: 0.58 / Mean I/σ(I) obs: 2.45 / % possible all: 99.3

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Processing

Software

Name	Version	Classification
REFMAC	5.5.0109	refinement
XDS		data reduction
XSCALE		data scaling
PHASER		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: PDB ENTRY 2IEE

2iee

Resolution: 2.32→48 Å / Cor.coef. F_o:F_c: 0.939 / Cor.coef. F_o:F_c free: 0.908 / SU B: 16.592 / SU ML: 0.202 / Cross valid method: THROUGHOUT / ESU R: 0.46 / ESU R Free: 0.275 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS.

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.26671	4052	5 %	RANDOM
R_work	0.21737	-	-	-
obs	0.21981	76978	100 %	-

Solvent computation

Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.4 Å / Solvent model: MASK

Displacement parameters

B_iso mean: 26.238 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	-1.24 Å²	0 Å²	0.31 Å²
2-	-	-0.29 Å²	0 Å²
3-	-	-	1.55 Å²

Refinement step

Cycle: LAST / Resolution: 2.32→48 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	14043	0	0	579	14622

Refine LS restraints

Refine-ID	Type	Dev ideal	Dev ideal target	Number
X-RAY DIFFRACTION	r_bond_refined_d	0.018	0.022	14318
X-RAY DIFFRACTION	r_bond_other_d	0.002	0.02	9315
X-RAY DIFFRACTION	r_angle_refined_deg	1.564	1.958	19410
X-RAY DIFFRACTION	r_angle_other_deg	1.068	3	23002
X-RAY DIFFRACTION	r_dihedral_angle_1_deg	6.121	5	1895
X-RAY DIFFRACTION	r_dihedral_angle_2_deg	38.689	26.187	577
X-RAY DIFFRACTION	r_dihedral_angle_3_deg	17.558	15	2418
X-RAY DIFFRACTION	r_dihedral_angle_4_deg	21.839	15	38
X-RAY DIFFRACTION	r_chiral_restr	0.089	0.2	2257
X-RAY DIFFRACTION	r_gen_planes_refined	0.007	0.02	16227
X-RAY DIFFRACTION	r_gen_planes_other	0.002	0.02	2623
X-RAY DIFFRACTION	r_nbd_refined
X-RAY DIFFRACTION	r_nbd_other
X-RAY DIFFRACTION	r_nbtor_refined
X-RAY DIFFRACTION	r_nbtor_other
X-RAY DIFFRACTION	r_xyhbond_nbd_refined
X-RAY DIFFRACTION	r_xyhbond_nbd_other
X-RAY DIFFRACTION	r_metal_ion_refined
X-RAY DIFFRACTION	r_metal_ion_other
X-RAY DIFFRACTION	r_symmetry_vdw_refined
X-RAY DIFFRACTION	r_symmetry_vdw_other
X-RAY DIFFRACTION	r_symmetry_hbond_refined
X-RAY DIFFRACTION	r_symmetry_hbond_other
X-RAY DIFFRACTION	r_symmetry_metal_ion_refined
X-RAY DIFFRACTION	r_symmetry_metal_ion_other
X-RAY DIFFRACTION	r_mcbond_it	0.659	1.5	9377
X-RAY DIFFRACTION	r_mcbond_other	0.161	1.5	3918
X-RAY DIFFRACTION	r_mcangle_it	1.241	2	14950
X-RAY DIFFRACTION	r_mcangle_other
X-RAY DIFFRACTION	r_scbond_it	2.1	3	4941
X-RAY DIFFRACTION	r_scbond_other
X-RAY DIFFRACTION	r_scangle_it	3.499	4.5	4460
X-RAY DIFFRACTION	r_scangle_other
X-RAY DIFFRACTION	r_long_range_B_refined
X-RAY DIFFRACTION	r_long_range_B_other
X-RAY DIFFRACTION	r_rigid_bond_restr
X-RAY DIFFRACTION	r_sphericity_free
X-RAY DIFFRACTION	r_sphericity_bonded

Refine LS restraints NCS

Refine-ID: X-RAY DIFFRACTION

Ens-ID	Dom-ID	Auth asym-ID	Number	Type	Rms dev position (Å)	Weight position
1	1	A	1351	tight positional	0.16	0.05
1	2	C	1351	tight positional	0.16	0.05
1	3	E	1351	tight positional	0.15	0.05
1	4	G	1351	tight positional	0.17	0.05
2	1	B	2760	tight positional	0.04	0.05
2	2	D	2760	tight positional	0.04	0.05
2	3	F	2760	tight positional	0.04	0.05
2	4	H	2760	tight positional	0.04	0.05
1	1	A	1455	medium positional	0.28	0.5
1	2	C	1455	medium positional	0.28	0.5
1	3	E	1455	medium positional	0.28	0.5
1	4	G	1455	medium positional	0.3	0.5
1	1	A	1351	tight thermal	0.58	0.5
1	2	C	1351	tight thermal	0.52	0.5
1	3	E	1351	tight thermal	0.58	0.5
1	4	G	1351	tight thermal	0.56	0.5
2	1	B	2760	tight thermal	0.11	0.5
2	2	D	2760	tight thermal	0.11	0.5
2	3	F	2760	tight thermal	0.11	0.5
2	4	H	2760	tight thermal	0.11	0.5
1	1	A	1455	medium thermal	0.67	2
1	2	C	1455	medium thermal	0.66	2
1	3	E	1455	medium thermal	0.7	2
1	4	G	1455	medium thermal	0.64	2

LS refinement shell

Resolution: 2.32→2.38 Å / Total num. of bins used: 20

	R_factor	Num. reflection	% reflection
R_free	0.349	296	-
R_work	0.288	5617	-
obs	-	-	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	1.8231	-0.4228	-0.5622	0.9566	0.4996	0.6476	-0.0092	0.2363	-0.2288	0.0635	0.0781	-0.05	0.0176	0.0929	-0.0689	0.0878	-0.0032	0.0229	0.0982	-0.0481	0.197	26.167	-13.165	47.129
2	6.0034	-1.0655	0.5033	3.364	0.0285	3.952	0.1271	-0.0676	0.7612	-0.1151	-0.0419	-0.171	-0.1887	-0.1637	-0.0853	0.0634	0.03	0.0095	0.02	0.0103	0.2898	4.796	7.388	53.028
3	2.7978	-0.9655	-0.222	1.2209	0.5514	0.7975	0.0116	0.4421	-0.189	-0.1435	-0.0415	0.109	-0.1277	0.0452	0.0299	0.0926	-0.0359	-0.0078	0.1523	-0.0145	0.1394	20.484	-6.339	40.279
4	0.8051	-0.1112	-0.0443	0.6682	-0.0029	0.273	-0.0347	-0.123	0.0601	-0.0301	0.0176	-0.1184	0.0071	-0.0291	0.0171	0.0877	0.0031	-0.0097	0.0806	-0.0252	0.2675	26.884	3.127	69.599
5	12.6771	0.7117	-3.6597	4.8779	-5.0837	21.7946	0.026	1.6174	0.0512	-2.235	-1.1037	-1.6006	4.4899	2.3405	1.0776	1.3949	0.7675	0.6977	0.6685	0.3383	0.5706	42.749	8.768	42.34
6	1.8675	0.4682	-0.4641	1.68	-0.2274	2.0471	-0.0902	-0.056	0.1937	-0.1527	0.002	-0.122	-0.1594	0.0203	0.0883	0.0762	0.0051	-0.0213	0.0028	-0.0194	0.3166	28.958	13.614	61.053
7	1.2175	0.3042	-0.0013	1.1286	0.423	0.6646	-0.0704	0.1	-0.2279	0.0579	0.0787	-0.0566	0.041	0.054	-0.0084	0.1145	-0.0017	0.0229	0.1669	-0.0379	0.1797	26.993	-12.989	111.977
8	4.2627	0.7591	-0.7121	3.513	1.0485	2.8973	-0.0453	-0.1454	0.2793	-0.2648	-0.0592	0.1768	-0.1309	-0.1054	0.1046	0.0909	0.0283	-0.076	0.1096	-0.0209	0.1399	3.674	9.846	115.057
9	2.3229	-1.1022	-0.9793	1.1364	0.6012	0.6897	-0.0885	0.3109	-0.1567	-0.0918	-0.0256	0.0794	-0.0909	-0.0204	0.1142	0.1054	-0.0486	-0.0201	0.2257	-0.0175	0.0868	19.737	-4.043	104.014
10	1.0776	-0.4052	0.0809	0.7151	-0.1547	0.6952	-0.0669	-0.1672	0.0944	-0.0289	0.0288	-0.1066	0.0306	0.0619	0.038	0.0889	0.011	-0.0227	0.2082	-0.0305	0.1658	26.002	6.41	132.802
11	4.2223	-0.3995	-1.2291	1.5631	-0.0757	5.1643	0.0091	0.1584	0.2378	-0.383	-0.123	-0.284	0.1252	0.4276	0.1138	0.1355	-0.0221	0.0648	0.144	0.0584	0.1676	38.466	13.377	110.187
12	1.5268	0.2339	-0.2708	2.1769	-0.4255	0.9671	-0.0779	-0.039	0.267	-0.0597	0.0904	-0.1016	-0.0657	-0.1432	-0.0124	0.1011	0.0301	-0.0658	0.1791	-0.0258	0.163	21.879	15.496	130.754
13	1.8292	0.873	-0.3517	1.9988	-0.5909	0.648	-0.0104	0.0953	0.1729	0.08	0.0562	0.1073	-0.0806	-0.0577	-0.0458	0.111	0.0281	-0.0354	0.0622	0.0177	0.1607	4.759	58.058	47.858
14	4.5653	-0.0514	1.3495	1.6641	-0.7005	1.9061	0.0277	0.1114	-0.2942	-0.22	-0.0108	-0.3278	0.1366	0.0524	-0.017	0.0934	0.0154	0.0464	0.0109	-0.0354	0.266	26.945	37.659	47.576
15	3.2962	0.1756	-1.1561	1.7556	-0.1737	2.508	-0.0874	0.2085	-0.0525	-0.069	0.0709	-0.0893	0.2017	-0.1532	0.0164	0.0615	-0.0241	-0.0167	0.0821	0.0008	0.0996	6.027	52.505	38.268
16	0.6808	-0.3224	-0.2095	0.8061	0.0292	0.4079	-0.0896	-0.0971	-0.1428	-0.0242	0.0415	0.0388	-0.048	-0.0148	0.048	0.0916	0.001	0.0144	0.1034	0.0385	0.2206	6.366	38.559	68.47
17	9.4601	-2.1527	-0.3859	11.2931	-1.6706	7.6212	0.1313	1.1171	0.2196	-1.049	-0.2748	0.7325	-0.6878	-0.8853	0.1435	0.2629	0.032	-0.1062	0.4167	-0.0718	0.1273	-8.856	34.643	41.342
18	1.1483	-0.1553	0.3421	1.1529	0.3663	2.4618	-0.0989	-0.0383	-0.3371	-0.1217	0.0066	0.1186	0.1319	-0.0449	0.0922	0.0872	0.0073	0.0552	0.0155	0.0132	0.3259	4.351	28.792	60.319
19	2.1448	0.2734	0.2226	1.6491	-0.5668	0.5471	-0.0132	0.0882	0.2792	0.1118	0.0647	0.0229	-0.0016	-0.0184	-0.0516	0.1137	-0.0166	-0.0227	0.2045	0.027	0.1405	3.168	60.42	112.38
20	4.7676	1.02	0.3288	4.7965	-0.2139	4.3714	-0.0256	0.1594	-0.7032	-0.2945	0.0031	-0.3437	0.1926	0.1007	0.0226	0.0835	0.0145	0.0392	0.1308	-0.0606	0.2866	26.979	37.508	114.685
21	2.5363	-1.161	0.8278	1.3564	-0.4681	0.8264	-0.0126	0.2837	-0.0806	-0.0789	-0.0142	-0.0885	0.0969	-0.0102	0.0268	0.1243	-0.0562	0.0054	0.2542	-0.0133	0.0898	10.486	51.586	104.348
22	0.5718	-0.3196	-0.0065	1.1396	0.1702	1.0634	0.011	-0.1019	-0.1025	-0.1077	0.0263	0.142	-0.0418	-0.0296	-0.0373	0.0728	0.0025	-0.0018	0.1992	0.0408	0.211	4.473	41.201	133.141
23	3.4813	1.7416	2.3058	5.9039	4.5788	5.9093	-0.3697	0.1759	-0.0835	-1.1914	-0.3657	1.2686	-0.852	-0.5063	0.7355	0.2685	0.0421	-0.2675	0.1659	-0.0673	0.4315	-6.978	34.722	112.371
24	3.8904	1.4324	0.6255	3.6847	0.9609	0.8901	-0.1788	0.0476	-0.3084	-0.0074	0.1594	0.0924	0.0341	0.1795	0.0195	0.09	0.0087	0.0493	0.1502	0.0338	0.1914	8.277	30.563	131.013

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Auth asym-ID	Auth seq-ID
1	X-RAY DIFFRACTION	1	A	39 - 150
2	X-RAY DIFFRACTION	2	A	151 - 199
3	X-RAY DIFFRACTION	3	A	200 - 275
4	X-RAY DIFFRACTION	4	B	38 - 141
5	X-RAY DIFFRACTION	5	B	142 - 201
6	X-RAY DIFFRACTION	6	B	202 - 275
7	X-RAY DIFFRACTION	7	C	39 - 137
8	X-RAY DIFFRACTION	8	C	138 - 203
9	X-RAY DIFFRACTION	9	C	204 - 275
10	X-RAY DIFFRACTION	10	D	38 - 146
11	X-RAY DIFFRACTION	11	D	147 - 231
12	X-RAY DIFFRACTION	12	D	232 - 275
13	X-RAY DIFFRACTION	13	E	39 - 136
14	X-RAY DIFFRACTION	14	E	137 - 229
15	X-RAY DIFFRACTION	15	E	230 - 275
16	X-RAY DIFFRACTION	16	F	38 - 145
17	X-RAY DIFFRACTION	17	F	146 - 198
18	X-RAY DIFFRACTION	18	F	199 - 275
19	X-RAY DIFFRACTION	19	G	39 - 137
20	X-RAY DIFFRACTION	20	G	138 - 200
21	X-RAY DIFFRACTION	21	G	201 - 275
22	X-RAY DIFFRACTION	22	H	38 - 145
23	X-RAY DIFFRACTION	23	H	146 - 237
24	X-RAY DIFFRACTION	24	H	238 - 275

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