PDB-6i9v: Crystal structure of the halohydrin dehalogenase HheG T123G mutant

ID or keywords:

Entry

Database: PDB / ID: 6i9v

Title

Crystal structure of the halohydrin dehalogenase HheG T123G mutant

Components

Putative oxidoreductase

Keywords

LYASE / halohydrin dehalogenase

Function / homology

Enoyl-(Acyl carrier protein) reductase / Short-chain dehydrogenase/reductase SDR / oxidoreductase activity / NAD(P)-binding domain superfamily / Putative oxidoreductase / Putative oxidoreductase

Function and homology information

Biological species

Ilumatobacter coccineus YM16-304 (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 2.8 Å

Authors

Kluenemann, T. / Blankenfeldt, W. / Schallmey, A.

Funding support

Germany, 2items

Citation

Journal: Sci Rep / Year: 2019
Title: Position 123 of halohydrin dehalogenase HheG plays an important role in stability, activity, and enantioselectivity.
Authors: Solarczek, J. / Klunemann, T. / Brandt, F. / Schrepfer, P. / Wolter, M. / Jacob, C.R. / Blankenfeldt, W. / Schallmey, A.

History

Deposition	Nov 26, 2018	Deposition site: PDBE / Processing site: PDBE
Revision 1.0	Aug 21, 2019	Provider: repository / Type: Initial release
Revision 1.1	Jan 24, 2024	Group: Data collection / Database references / Refinement description Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	6i9v.cif.gz	1 MB	Display	PDBx/mmCIF format
PDB format	pdb6i9v.ent.gz	924.1 KB	Display	PDB format
PDBx/mmJSON format	6i9v.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Summary document	6i9v_validation.pdf.gz	474.8 KB	Display	wwPDB validaton report
Full document	6i9v_full_validation.pdf.gz	488.1 KB	Display
Data in XML	6i9v_validation.xml.gz	66.5 KB	Display
Data in CIF	6i9v_validation.cif.gz	89.1 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/i9/6i9v ftp://data.pdbj.org/pub/pdb/validation_reports/i9/6i9v	HTTPS FTP

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Related structure data

Related structure data	6i9uC 6i9wC 5o30S S: Starting model for refinement C: citing same article (ref.)
Similar structure data	6i9w-d 5o30-4 5o30-3 6i9u-2 6i9u-1 5o30-2 6i9u-4 5o30-1 6pzn-d 6i9u-3 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	#90 - Jun 2007 Fatty Acid Synthase similarity (1) #77 - May 2006 Glucose Oxidase similarity (1)

Deposited unit

A: Putative oxidoreductase

B: Putative oxidoreductase

C: Putative oxidoreductase

D: Putative oxidoreductase

E: Putative oxidoreductase

F: Putative oxidoreductase

G: Putative oxidoreductase

H: Putative oxidoreductase

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

1

A: Putative oxidoreductase

D: Putative oxidoreductase

E: Putative oxidoreductase

G: Putative oxidoreductase

defined by author&software
109 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

2

B: Putative oxidoreductase

C: Putative oxidoreductase

F: Putative oxidoreductase

H: Putative oxidoreductase

defined by author&software
109 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

Unit cell

Length a, b, c (Å)	102.033, 141.320, 172.525
Angle α, β, γ (deg.)	90.000, 90.000, 90.000
Int Tables number	18
Space group name H-M	P2₁2₁2

#1: Protein	Putative oxidoreductase Mass: 27296.926 Da / Num. of mol.: 8 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Ilumatobacter coccineus YM16-304 (bacteria) Gene: YM304_35350 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: M5A5Y8, UniProt: A0A6C7EF96*PLUS
#2: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 49 / 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: 2.6 Å³/Da / Density % sol: 52.74 %
Crystal grow	Temperature: 297 K / Method: vapor diffusion, sitting drop / Details: 0.2M Sodium thiocyanate 20% PEG 3350

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Data collection

Diffraction

Mean temperature: 100 K / Serial crystal experiment: N

Diffraction source

Source:

SYNCHROTRON / Site:

SLS

/ Beamline: X06DA / Wavelength: 1.00003 Å

Detector

Type: DECTRIS PILATUS3 2M / Detector: PIXEL / Date: Apr 12, 2018

Radiation

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

Radiation wavelength

Wavelength: 1.00003 Å / Relative weight: 1

Reflection

Resolution: 2.8→172.52 Å / Num. obs: 62219 / % possible obs: 100 % / Redundancy: 13 % / CC_1/2: 0.996 / R_merge(I) obs: 0.201 / R_pim(I) all: 0.058 / R_rim(I) all: 0.209 / Net I/σ(I): 9.5

Reflection shell

Diffraction-ID: 1 / % possible all: 100

Resolution (Å)	Redundancy (%)	R_merge(I) obs	Num. measured all	Num. unique obs	CC_1/2	R_pim(I) all	R_rim(I) all	Net I/σ(I) obs
2.8-2.87	12.4	0.971	56362	4542	0.947	0.287	1.013	2.7
12.52-172.52	12	0.056	9669	809	0.998	0.017	0.059	17

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Processing

Software

Name	Version	Classification
PHENIX		refinement
Aimless	0.7.1	data scaling
PDB_EXTRACT	3.24	data extraction
DIALS		data reduction
PHASER		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: 5o30

5o30

Resolution: 2.8→172.52 Å / SU ML: 0.38 / Cross valid method: THROUGHOUT / σ(F): 1.42 / Phase error: 28.54

	R_factor	Num. reflection	% reflection
R_free	0.259	3078	4.97 %
R_work	0.222	-	-
obs	0.2238	61974	99.68 %

Solvent computation

Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å

Displacement parameters

B_iso max: 247.53 Å² / B_iso mean: 75.1397 Å² / B_iso min: 19.62 Å²

Refinement step

Cycle: final / Resolution: 2.8→172.52 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	15053	0	0	49	15102
B_iso mean	-	-	-	31.42	-
Num. residues	-	-	-	-	2053

LS refinement shell

Refine-ID: X-RAY DIFFRACTION / R_factor R_free error: 0

Resolution (Å)	R_factor R_free	Num. reflection R_free	R_factor R_work	Num. reflection R_work	% reflection obs (%)
2.8-2.8438	0.3431	141	0.3322	2654	100
2.8438-2.8904	0.3468	139	0.3161	2633	100
2.8904-2.9402	0.3083	128	0.2912	2633	99
2.9402-2.9937	0.3064	133	0.2905	2675	100
2.9937-3.0513	0.317	136	0.2781	2617	100
3.0513-3.1136	0.3288	143	0.2834	2640	100
3.1136-3.1813	0.3231	155	0.2699	2668	100
3.1813-3.2553	0.2995	100	0.2654	2648	100
3.2553-3.3367	0.283	133	0.2626	2672	100
3.3367-3.4269	0.2653	130	0.235	2640	100
3.4269-3.5278	0.277	153	0.2369	2675	100
3.5278-3.6417	0.2939	163	0.2316	2642	100
3.6417-3.7718	0.2475	137	0.2152	2657	100
3.7718-3.9229	0.2739	136	0.2083	2682	100
3.9229-4.1014	0.2149	120	0.1919	2665	100
4.1014-4.3177	0.2518	153	0.1905	2684	100
4.3177-4.5882	0.1885	136	0.1831	2685	100
4.5882-4.9425	0.2286	162	0.1776	2668	100
4.9425-5.4399	0.2273	126	0.1986	2742	100
5.4399-6.2271	0.2675	126	0.218	2734	100
6.2271-7.8455	0.2434	152	0.2091	2762	100
7.8455-172.52	0.2262	176	0.1955	2820	98

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	4.8139	3.2605	0.2373	6.1297	2.0924	3.1899	0.2885	-0.6641	-0.0466	0.7358	-0.1507	-0.5343	0.0954	0.3559	-0.1243	0.8287	-0.4242	-0.0785	0.8132	0.0521	0.4257	-75.429	-28.1962	-34.2097
2	1.4713	2.0231	0.2036	5.2657	0.2641	0.0284	0.3751	-0.5874	-0.0027	1.2396	-0.6221	0.5831	0.4663	-0.4094	0.2329	1.1292	-0.5795	0.1136	0.9532	-0.0696	0.5127	-89.4288	-32.5773	-32.0834
3	0.88	-0.0469	-0.1548	3.3857	1.1861	1.6049	0.1285	-0.3911	-0.0175	0.5568	-0.0898	-0.0039	0.0453	0.0581	-0.0311	0.4674	-0.2581	-0.0682	0.4789	0.0353	0.3405	-82.6607	-38.4901	-49.8669
4	1.38	-2.6623	-1.8957	7.5156	1.8608	3.9574	0.1872	0.4754	-0.2555	0.0199	-0.1766	0.8168	0.0244	-0.8538	0.0002	0.4178	-0.2184	0.005	0.4853	-0.0243	0.457	-89.1507	-25.9585	-50.5896
5	8.6472	4.8545	-4.892	8.2338	0.8101	5.6249	-0.295	-0.8644	-1.0727	0.5232	0.1053	-2.2936	1.4279	2.4534	0.1599	0.5977	0.0844	-0.0825	0.9046	0.0859	0.989	-59.7932	-37.4609	-51.135
6	1.8873	-0.2415	0.6367	4.0329	1.5415	1.521	0.1014	0.0039	0.4916	0.14	-0.049	-0.398	-0.2765	0.385	-0.0743	0.4069	-0.2694	-0.0247	0.485	0.0572	0.4255	-73.517	-25.2507	-53.7107
7	6.3597	-0.6257	0.2639	1.1878	-1.7357	3.1756	0.0251	-0.0003	0.3933	-0.242	0.0853	0.3051	-0.0926	-0.2883	-0.0835	0.7628	0.4191	-0.0042	0.7227	0.0301	0.2932	-75.4726	28.8424	-48.8731
8	9.5198	-3.0399	-0.0561	1.1362	-0.4872	1.5767	0.3205	0.2414	0.2814	-0.1005	-0.0451	-0.7289	-0.0779	0.0345	-0.1663	0.7099	0.4125	-0.0291	0.7086	0.0197	0.4515	-72.3185	30.9294	-52.6814
9	2.8944	-3.9411	-0.8387	7.8002	1.0521	0.2464	0.4345	0.8408	-0.1531	-1.1752	-0.4006	0.9172	-0.3243	-0.6874	-0.0105	0.8655	0.3739	-0.1164	0.8638	0.0418	0.4735	-87.0138	33.7882	-54.1345
10	1.7354	0.1383	-0.0559	5.4393	2.855	2.6702	0.0378	0.2169	-0.221	0.1042	0.437	-0.732	0.1004	0.388	-0.441	0.5003	0.348	0.0179	0.6234	0.0048	0.2826	-76.5647	42.8513	-38.5861
11	3.6028	3.0301	3.0891	4.5588	4.2977	4.4174	-0.0267	0.3374	0.0475	-0.5197	-0.043	0.3219	-0.1371	-0.0017	0.0235	0.6726	0.4011	0.0302	0.8196	0.1152	0.3722	-84.8746	41.5594	-40.886
12	1.4218	-2.0625	-0.5351	3.3321	0.3979	0.6236	0.1243	0.1361	-0.0742	-0.2318	-0.1375	-0.2227	-0.0089	-0.1027	0.0448	0.569	0.3769	0.0063	0.6159	-0.0109	0.2908	-78.9401	38.0964	-31.9214
13	1.391	-1.4533	0.5999	1.6062	-0.1319	3.0604	-0.0549	0.3059	0.562	-0.1899	0.1995	0.043	-0.0419	0.4394	-0.1317	0.6976	0.3422	-0.0947	0.7119	-0.0075	0.4371	-70.7204	35.1284	-36.8473
14	3.9752	-0.1354	0.6001	4.1075	1.6961	3.5023	0.1127	-0.001	-0.0098	-0.1675	0.2988	-0.85	0.2168	0.6504	-0.4167	0.6162	0.411	0.0151	0.7497	-0.0466	0.5533	-66.9329	30.2832	-32.6076
15	0.6053	-0.5992	-0.234	1.5915	0.2043	0.3714	0.0005	0.0338	0.1062	-0.0005	-0.0045	0.1957	-0.0941	-0.1272	-0.084	0.9198	0.6973	0.0013	0.9761	0.0389	0.4994	-94.6624	63.9459	-15.3206
16	1.1788	-0.9395	-0.1738	1.2995	0.0416	0.1544	-0.0142	0.1354	-0.0845	0.0156	-0.0691	0.2339	-0.12	-0.147	0.0825	0.704	0.4791	0.023	0.8669	0.0476	0.3867	-92.0706	49.7909	-26.1794
17	1.5645	-1.0251	0.1193	2.2953	-0.0629	0.6448	-0.1329	-0.153	0.1033	0.0013	0.0769	0.205	-0.1254	-0.0962	0.1529	0.7119	0.4597	-0.0273	0.7016	0.026	0.3847	-85.5495	54.998	-28.3099
18	2.4824	-1.8405	0.1972	2.6419	-0.4857	0.3169	0.0288	-0.0093	-0.0093	0.0277	-0.0105	-0.074	0.0133	-0.0377	-0.0069	0.5851	0.4188	0.0258	0.7274	0.0517	0.2955	-83.843	46.5539	-22.0237
19	0.8656	0.0619	0.238	3.6232	-0.1483	1.0872	-0.0312	-0.2515	-0.0693	-0.0528	0.0962	0.5494	-0.1259	-0.5634	-0.145	0.6374	0.5159	0.0121	0.9644	0.1374	0.4556	-94.6614	43.6612	-12.9405
20	1.8263	0.9634	-0.049	1.7736	-0.2034	0.4843	-0.0634	0.1224	-0.1197	-0.0852	0.0698	-0.0087	0.035	0.0213	0.0581	0.3525	-0.2496	0.0213	0.3611	0.0359	0.41	-93.4389	-60.3336	-75.8911
21	9.4024	2.5621	5.433	5.5964	2.3369	3.2892	0.43	-1.8733	0.2086	1.5641	-1.1422	1.2031	0.4216	-0.9708	0.6828	0.6874	-0.4104	0.086	0.7222	-0.0178	0.6311	-104.6669	-63.1558	-71.5108
22	0.3008	0.4206	0.2704	0.9862	0.7609	0.8458	0.0654	-0.2041	-0.1843	0.3445	-0.2557	0.1971	0.1244	-0.0453	0.1656	0.4858	-0.3029	0.0164	0.4757	0.0396	0.4455	-91.4763	-59.5937	-63.383
23	0.4899	0.5471	0.0367	1.9612	0.2648	0.8835	0.0139	-0.1121	-0.0854	0.2525	-0.1073	-0.0419	0.0278	-0.011	0.0151	0.3431	-0.2675	-0.0054	0.4077	0.0499	0.406	-88.2794	-48.0465	-63.4026
24	8.2485	-2.0491	5.627	4.9757	2.0379	7.2679	-0.168	-0.4684	-0.9199	0.5397	0.1253	2.0349	1.0793	-2.1093	0.0295	0.4193	-0.1352	0.0507	0.888	0.0097	0.9763	-111.8613	-37.4497	-68.7832
25	1.8473	0.239	-0.1916	1.2829	0.3412	0.4526	-0.0634	0.0855	0.0301	-0.0955	-0.0406	0.1954	0.0129	-0.0634	0.0135	0.32	-0.2439	-0.0289	0.3495	0.0871	0.4095	-92.0892	-43.6588	-76.359
26	5.2627	-0.4237	-1.6348	4.4558	-0.895	1.8597	-0.1686	0.3032	0.2347	-0.2981	0.2409	-0.359	-0.0853	0.1019	-0.0063	0.6647	-0.4548	-0.0522	0.7159	0.0772	0.4419	-82.5525	-39.6628	-99.5893
27	0.792	0.8134	-0.3015	1.6801	-0.2089	0.6834	-0.2615	0.421	0.1559	-0.501	0.2282	-0.0515	-0.1742	0.106	0.0074	0.522	-0.3406	-0.0275	0.5843	0.1125	0.4547	-80.3689	-32.7486	-87.0445
28	3.2032	-1.6588	3.1209	3.5362	-2.3492	4.0089	0.0462	-0.1647	-0.1339	0.0788	0.0928	0.0637	-0.0123	-0.0712	-0.0284	1.0647	0.6323	0.0073	0.9973	0.072	0.4402	-80.4374	41.778	13.2036
29	0.3917	-0.0593	0.5866	0.6582	-0.3679	0.9972	0.0321	-0.3952	-0.2052	0.3411	0.339	0.1882	0.168	-0.3487	-0.2423	1.0514	0.5112	-0.0626	1.1507	0.2625	0.6437	-78.9802	27.9652	7.4584
30	1.1405	-0.6986	0.3498	2.2044	-0.6068	1.041	0.0366	-0.2358	-0.1383	0.2184	0.1632	-0.1408	0.0405	-0.0407	0.1018	0.7469	0.4907	-0.095	0.8049	0.0837	0.4016	-75.8676	39.32	-4.0091
31	1.5215	0.2864	-0.0923	1.3834	1.5696	2.5341	0.1119	0.007	0.8705	-0.1195	-0.0257	-0.1566	-0.5812	0.1413	-0.0845	1.0664	-0.3785	-0.0596	0.4988	0.074	0.9885	-71.3533	-0.0969	-63.7814
32	1.1674	0.3117	0.2496	1.6013	0.1239	0.5183	0.0142	0.0491	0.547	-0.2819	0.0915	0.0973	-0.1835	0.0688	-0.0457	0.6751	-0.3578	-0.1577	0.5516	0.1607	0.7012	-75.4912	-11.9916	-75.5579
33	2.3247	1.5011	0.5836	2.1334	0.576	2.2493	-0.3379	0.1434	0.46	-0.391	0.149	0.1604	-0.4695	0.0455	0.1454	0.4829	-0.2322	-0.1067	0.3914	0.0798	0.558	-78.9491	-17.6071	-68.6081
34	7.302	-3.4879	5.3492	7.6601	-5.0302	5.0173	-0.051	0.0032	2.2413	-0.0419	0.1902	1.6005	-2.4783	-1.3175	-0.1342	1.1217	0.1639	0.0004	0.9546	-0.0731	1.4305	-100.9939	-9.4868	-62.8874
35	6.6381	-0.7872	1.1067	1.7705	0.1017	1.5624	-0.1051	-0.4047	0.7536	0.4452	-0.1355	0.1017	-0.478	0.1283	0.2578	0.5737	-0.197	-0.0025	0.3459	0.0193	0.5018	-80.8084	-17.3349	-57.7249
36	1.4574	-0.3618	0.0709	0.1713	0.298	1.2284	0.1523	-0.1271	-0.9324	0.0484	0.1119	0.3459	0.6334	0.1614	-0.253	1.8569	0.6778	-0.2294	0.9312	0.0867	1.1624	-67.4877	2.3736	-24.6436
37	0.406	-0.1603	-0.2284	0.136	0.1532	0.1832	-0.3445	-0.4791	-0.4314	0.5757	0.1465	-0.3129	0.1158	0.2049	0.1739	1.3804	0.7294	-0.1283	1.0475	0.0203	1.1107	-58.1008	7.804	-17.5594
38	1.7168	-0.8929	0.5715	0.8704	-0.0824	0.6847	0.2256	-0.13	-0.5826	0.2752	0.2155	0.2984	0.0534	-0.2735	-0.4036	1.3094	0.5785	-0.1024	0.9135	0.1729	0.865	-73.253	15.3524	-8.0028
39	0.4255	-0.2055	0.2131	0.838	0.2757	1.2398	0.3272	0.6866	0.5587	-0.2028	-0.1313	-0.1002	0.0146	-0.498	-0.1979	1.0411	0.4649	-0.0786	0.7617	0.0974	0.5678	-76.4339	20.2335	-17.7839
40	0.0815	-0.4512	0.5743	3.7028	-2.5998	4.3383	0.1292	-0.1636	-0.6191	0.0762	-0.0287	-0.0931	0.3151	0.484	-0.0767	0.9218	0.4412	-0.2304	0.7077	-0.0039	0.6334	-68.9446	24.3818	-14.4974
41	0.7805	1.2888	-0.6477	2.9709	-1.2514	2.3236	-0.0792	0.2341	-0.7572	-0.1617	0.3282	-0.0811	0.7552	-0.3378	-0.2498	1.1817	0.3763	-0.0179	0.8927	0.0614	0.5458	-79.2682	13.9694	-22.2907
42	3.044	-0.2124	-1.5187	0.0176	0.1034	0.76	-0.1949	-0.248	-1.5288	0.52	0.2506	0.7327	1.2449	-0.6206	-0.0668	1.5296	-0.2722	0.0377	1.4179	0.0952	1.4424	-96.3018	9.1606	-23.6581
43	3.259	0.8453	0.571	0.4525	-0.5095	1.961	0.1039	0.0126	-0.518	-0.3398	0.1755	0.0427	0.6431	-0.1112	-0.2737	0.9866	0.3529	-0.1373	0.636	0.0643	0.6769	-76.3862	19.5006	-28.668

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 6 through 76 )	A	6 - 76
2	X-RAY DIFFRACTION	2	chain 'A' and (resid 77 through 91 )	A	77 - 91
3	X-RAY DIFFRACTION	3	chain 'A' and (resid 92 through 182 )	A	92 - 182
4	X-RAY DIFFRACTION	4	chain 'A' and (resid 183 through 195 )	A	183 - 195
5	X-RAY DIFFRACTION	5	chain 'A' and (resid 196 through 220 )	A	196 - 220
6	X-RAY DIFFRACTION	6	chain 'A' and (resid 221 through 262 )	A	221 - 262
7	X-RAY DIFFRACTION	7	chain 'B' and (resid 6 through 19 )	B	6 - 19
8	X-RAY DIFFRACTION	8	chain 'B' and (resid 20 through 76 )	B	20 - 76
9	X-RAY DIFFRACTION	9	chain 'B' and (resid 77 through 91 )	B	77 - 91
10	X-RAY DIFFRACTION	10	chain 'B' and (resid 92 through 113 )	B	92 - 113
11	X-RAY DIFFRACTION	11	chain 'B' and (resid 114 through 142 )	B	114 - 142
12	X-RAY DIFFRACTION	12	chain 'B' and (resid 143 through 182 )	B	143 - 182
13	X-RAY DIFFRACTION	13	chain 'B' and (resid 183 through 212 )	B	183 - 212
14	X-RAY DIFFRACTION	14	chain 'B' and (resid 213 through 262 )	B	213 - 262
15	X-RAY DIFFRACTION	15	chain 'C' and (resid 6 through 91 )	C	6 - 91
16	X-RAY DIFFRACTION	16	chain 'C' and (resid 92 through 113 )	C	92 - 113
17	X-RAY DIFFRACTION	17	chain 'C' and (resid 114 through 142 )	C	114 - 142
18	X-RAY DIFFRACTION	18	chain 'C' and (resid 143 through 186 )	C	143 - 186
19	X-RAY DIFFRACTION	19	chain 'C' and (resid 187 through 262 )	C	187 - 262
20	X-RAY DIFFRACTION	20	chain 'D' and (resid 6 through 37 )	D	6 - 37
21	X-RAY DIFFRACTION	21	chain 'D' and (resid 38 through 61 )	D	38 - 61
22	X-RAY DIFFRACTION	22	chain 'D' and (resid 62 through 113 )	D	62 - 113
23	X-RAY DIFFRACTION	23	chain 'D' and (resid 114 through 206 )	D	114 - 206
24	X-RAY DIFFRACTION	24	chain 'D' and (resid 207 through 221 )	D	207 - 221
25	X-RAY DIFFRACTION	25	chain 'D' and (resid 222 through 262 )	D	222 - 262
26	X-RAY DIFFRACTION	26	chain 'E' and (resid 6 through 61 )	E	6 - 61
27	X-RAY DIFFRACTION	27	chain 'E' and (resid 62 through 262 )	E	62 - 262
28	X-RAY DIFFRACTION	28	chain 'F' and (resid 6 through 61 )	F	6 - 61
29	X-RAY DIFFRACTION	29	chain 'F' and (resid 62 through 141 )	F	62 - 141
30	X-RAY DIFFRACTION	30	chain 'F' and (resid 142 through 262 )	F	142 - 262
31	X-RAY DIFFRACTION	31	chain 'G' and (resid 6 through 90 )	G	6 - 90
32	X-RAY DIFFRACTION	32	chain 'G' and (resid 91 through 142 )	G	91 - 142
33	X-RAY DIFFRACTION	33	chain 'G' and (resid 143 through 206 )	G	143 - 206
34	X-RAY DIFFRACTION	34	chain 'G' and (resid 207 through 222 )	G	207 - 222
35	X-RAY DIFFRACTION	35	chain 'G' and (resid 223 through 262 )	G	223 - 262
36	X-RAY DIFFRACTION	36	chain 'H' and (resid 6 through 76 )	H	6 - 76
37	X-RAY DIFFRACTION	37	chain 'H' and (resid 77 through 100 )	H	77 - 100
38	X-RAY DIFFRACTION	38	chain 'H' and (resid 101 through 142 )	H	101 - 142
39	X-RAY DIFFRACTION	39	chain 'H' and (resid 143 through 162 )	H	143 - 162
40	X-RAY DIFFRACTION	40	chain 'H' and (resid 163 through 186 )	H	163 - 186
41	X-RAY DIFFRACTION	41	chain 'H' and (resid 187 through 207 )	H	187 - 207
42	X-RAY DIFFRACTION	42	chain 'H' and (resid 208 through 222 )	H	208 - 222
43	X-RAY DIFFRACTION	43	chain 'H' and (resid 223 through 262 )	H	223 - 262

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