PDB-4kpe: Novel fluoroquinolones in complex with topoisomerase IV from S. p...

ID or keywords:

Entry

Database: PDB / ID: 4kpe

Title

Novel fluoroquinolones in complex with topoisomerase IV from S. pneumoniae and E-site G-gate

Components

(DNA topoisomerase 4 subunit ...Topoisomerase) x 2
E-site DNA1
E-site DNA2
E-site DNA3
E-site DNA4

Keywords

ISOMERASE/DNA/INHIBITOR / PROTEIN-DNA CLEAVAGE COMPLEX / ISOMERASE-DNA-INHIBITOR COMPLEX / TOPOISOMERASE IIA / Quinolone / ACHN-245

Function / homology

Function and homology information

DNA topoisomerase type II (double strand cut, ATP-hydrolyzing) complex / DNA topoisomerase type II (double strand cut, ATP-hydrolyzing) activity /

DNA topoisomerase (ATP-hydrolysing) /

extrinsic component of plasma membrane / DNA topological change /

chromosome segregation /

chromosome /

DNA binding /

ATP binding /

metal ion binding /

cytoplasm
Similarity search - Function

Biological species

Streptococcus pneumoniae (bacteria)

Streptococcus pneumoniae serotype 4 (bacteria)
synthetic construct (others)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 3.43 Å

Authors

Laponogov, I. / Pan, X.-S. / Vesekov, D.A. / Cirz, R.T. / Wagman, A.S. / Moser, H.E. / Fisher, L.M. / Sanderson, M.R.

Citation

Journal: Open Biol / Year: 2016
Title: Exploring the active site of the Streptococcus pneumoniae topoisomerase IV-DNA cleavage complex with novel 7,8-bridged fluoroquinolones.
Authors: Laponogov, I. / Pan, X.S. / Veselkov, D.A. / Cirz, R.T. / Wagman, A. / Moser, H.E. / Fisher, L.M. / Sanderson, M.R.

History

Deposition	May 13, 2013	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Nov 26, 2014	Provider: repository / Type: Initial release
Revision 1.1	Oct 3, 2018	Group: Data collection / Database references / Source and taxonomy Category: citation / citation_author / pdbx_entity_src_syn Item: _citation.country / _citation.journal_abbrev ..._citation.country / _citation.journal_abbrev / _citation.journal_id_CSD / _citation.journal_id_ISSN / _citation.journal_volume / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year / _citation_author.identifier_ORCID / _citation_author.name / _pdbx_entity_src_syn.details / _pdbx_entity_src_syn.ncbi_taxonomy_id / _pdbx_entity_src_syn.organism_scientific
Revision 1.2	Jan 29, 2020	Group: Data collection / Database references / Derived calculations Category: reflns / struct_conn / struct_ref_seq_dif Item: _reflns.pdbx_Rmerge_I_obs / _struct_conn.pdbx_leaving_atom_flag / _struct_ref_seq_dif.details

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	4kpe.cif.gz	579.8 KB	Display	PDBx/mmCIF format
PDB format	pdb4kpe.ent.gz	487 KB	Display	PDB format
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Others	Other downloads

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Validation report

Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/kp/4kpe ftp://data.pdbj.org/pub/pdb/validation_reports/kp/4kpe	HTTPS FTP

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Related structure data

Related structure data	3radC 4kpfC 2nov 3foe 3fof 3k9f 3ksa 3ksb 3ltn 3rae 3raf 4koe C: citing same article (ref.)
Similar structure data	3raf-d 3rad-d 4z3o-d 4z4q-d 3ltn-d 4kpf-d 6waa-1 6qx1-d 3rae-d 4z2c-d 5cdq-1 6qx2-6 2xcs-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
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PDB pages

PDBj /

wwPDB /

NCBI

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Deposited unit

A: DNA topoisomerase 4 subunit A

B: DNA topoisomerase 4 subunit A

C: DNA topoisomerase 4 subunit B

D: DNA topoisomerase 4 subunit B

E: E-site DNA1

F: E-site DNA2

G: E-site DNA3

H: E-site DNA4

hetero molecules

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

1

Idetical with deposited unit
defined by author

Unit cell

Length a, b, c (Å)	157.830, 157.830, 210.710
Angle α, β, γ (deg.)	90.00, 90.00, 120.00
Int Tables number	152
Space group name H-M	P3₁21

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DNA topoisomerase 4 subunit ... , 2 types, 4 molecules ABCD

#1: Protein	DNA topoisomerase 4 subunit A / Topoisomerase / Topoisomerase IV subunit A Mass: 56455.434 Da / Num. of mol.: 2 / Fragment: ParC55, UNP residues 1-488 / Mutation: I257T Source method: isolated from a genetically manipulated source Source: (gene. exp.) Streptococcus pneumoniae (bacteria) / Strain: ATCC BAA-334 / TIGR4 / Gene: parC, SP_0855 / Production host: Escherichia coli (E. coli) / References: UniProt: P72525, EC: 5.99.1.3
#2: Protein	DNA topoisomerase 4 subunit B / Topoisomerase Mass: 30415.703 Da / Num. of mol.: 2 / Fragment: ParE30, UNP residues 404-647 / Mutation: V460I, T644A Source method: isolated from a genetically manipulated source Source: (gene. exp.) Streptococcus pneumoniae serotype 4 (bacteria) Strain: ATCC BAA-334 / TIGR4 / Gene: parE / Production host: Escherichia coli (E. coli) / References: UniProt: Q59961, EC: 5.99.1.3

#1: Protein

DNA topoisomerase 4 subunit A /

Topoisomerase / Topoisomerase IV subunit A

Mass: 56455.434 Da / Num. of mol.: 2 / Fragment: ParC55, UNP residues 1-488 / Mutation: I257T
Source method: isolated from a genetically manipulated source
Source: (gene. exp.)

Streptococcus pneumoniae (bacteria) / Strain: ATCC BAA-334 / TIGR4 / Gene: parC, SP_0855 / Production host:

Escherichia coli (E. coli) / References: UniProt: P72525, EC: 5.99.1.3

#2: Protein

DNA topoisomerase 4 subunit B /

Topoisomerase

Mass: 30415.703 Da / Num. of mol.: 2 / Fragment: ParE30, UNP residues 404-647 / Mutation: V460I, T644A
Source method: isolated from a genetically manipulated source
Source: (gene. exp.)

Streptococcus pneumoniae serotype 4 (bacteria)
Strain: ATCC BAA-334 / TIGR4 / Gene: parE / Production host:

Escherichia coli (E. coli) / References: UniProt: Q59961, EC: 5.99.1.3

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DNA chain , 4 types, 4 molecules EFGH

#3: DNA chain	E-site DNA1 Mass: 2121.436 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) synthetic construct (others)
#4: DNA chain	E-site DNA2 Mass: 3348.209 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) synthetic construct (others)
#5: DNA chain	E-site DNA3 Mass: 2113.410 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) synthetic construct (others)
#6: DNA chain	E-site DNA4 Mass: 3358.211 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) synthetic construct (others)

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Non-polymers , 3 types, 32 molecules

#7: Chemical	ChemComp-MG / MAGNESIUM ION Mass: 24.305 Da / Num. of mol.: 6 / Source method: obtained synthetically / Formula: Mg
#8: Chemical	ChemComp-AF5 / (7aR,8R)-8-amino-4-cyclopropyl-12-fluoro-1-oxo-4,7,7a,8,9,10-hexahydro-1H-pyrrolo[1',2':1,7]azepino[2,3-h]quinoline-2-carboxylic acid Mass: 369.390 Da / Num. of mol.: 2 / Source method: obtained synthetically / Formula: C₂₀H₂₀FN₃O₃
#9: Water	ChemComp-HOH / water / Water Mass: 18.015 Da / Num. of mol.: 24 / 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: 4.1 Å³/Da / Density % sol: 70.02 %
Crystal grow	Temperature: 295 K / Method: vapor diffusion, sitting drop / pH: 6.5 Details: 50 mM Na Cacodylate, 4-7% isopropanol, optimized mixture of salts, pH 6.5, VAPOR DIFFUSION, SITTING DROP, temperature 295K

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: Diamond / Beamline: I02 / Wavelength: 0.9795 Å
Detector	Type: ADSC QUANTUM 315 / Detector: CCD / Date: May 6, 2011
Radiation	Monochromator: DOUBLE CRYSTAL / Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.9795 Å / Relative weight: 1
Reflection	Resolution: 3.43→41.819 Å / Num. all: 41232 / Num. obs: 40043 / % possible obs: 97.1 % / Observed criterion σ(F): -3 / Observed criterion σ(I): -3 / Redundancy: 5.16 % / R_merge(I) obs: 0.122 / Net I/σ(I): 14.38
Reflection shell	Resolution: 3.43→3.52 Å / Redundancy: 5.22 % / R_merge(I) obs: 0.398 / Mean I/σ(I) obs: 6.37 / % possible all: 98.2

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Processing

Software

Name	Version	Classification
GDE		data collection
PHASER		phasing
PHENIX	(phenix.refine: 1.8_1069)	refinement
XDS		data reduction
XSCALE		data scaling

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT / Resolution: 3.43→41.819 Å / SU ML: 0.28 / Cross valid method: THROUGHOUT / σ(F): 2.01 / Phase error: 18.46 / Stereochemistry target values: ML

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.1947	2003	5.01 %	Random
R_work	0.1541	-	-	-
obs	0.1562	40016	97.13 %	-
all	-	40043	-	-

Solvent computation

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

Refinement step

Cycle: LAST / Resolution: 3.43→41.819 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	10388	730	60	24	11202

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.009	11462
X-RAY DIFFRACTION	f_angle_d	1.24	15726
X-RAY DIFFRACTION	f_dihedral_angle_d	18.567	4216
X-RAY DIFFRACTION	f_chiral_restr	0.077	1810
X-RAY DIFFRACTION	f_plane_restr	0.004	1922

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 (%)
3.43-3.5157	0.2386	134	0.1825	2722	X-RAY DIFFRACTION	98
3.5157-3.6107	0.1905	144	0.1795	2688	X-RAY DIFFRACTION	99
3.6107-3.7169	0.2267	140	0.1676	2719	X-RAY DIFFRACTION	98
3.7169-3.8368	0.2249	145	0.1557	2721	X-RAY DIFFRACTION	98
3.8368-3.9739	0.1672	148	0.1456	2688	X-RAY DIFFRACTION	98
3.9739-4.1328	0.1796	134	0.1388	2723	X-RAY DIFFRACTION	98
4.1328-4.3207	0.1677	147	0.1314	2719	X-RAY DIFFRACTION	98
4.3207-4.5483	0.1542	144	0.1274	2710	X-RAY DIFFRACTION	97
4.5483-4.8329	0.1987	140	0.1342	2698	X-RAY DIFFRACTION	98
4.8329-5.2054	0.2107	147	0.1479	2723	X-RAY DIFFRACTION	97
5.2054-5.728	0.2076	145	0.1602	2728	X-RAY DIFFRACTION	97
5.728-6.5541	0.2202	144	0.1731	2724	X-RAY DIFFRACTION	97
6.5541-8.2471	0.1796	148	0.1556	2740	X-RAY DIFFRACTION	96
8.2471-41.8217	0.1942	143	0.1697	2710	X-RAY DIFFRACTION	91

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	-0.1993	0.7585	0.4253	3.045	4.0187	2.7454	-0.0741	-0.0203	0.1085	0.4315	-0.0669	0.5409	0.1342	-0.1474	0.1219	0.4372	-0.036	0.0102	0.3473	0.0484	0.2505	79.475	-39.5237	44.45
2	3.7226	0.8317	-0.2716	4.6875	-0.1518	5.3139	0.057	-0.2696	-0.0591	0.0075	-0.1794	0.6644	0.1283	-0.4823	0.1172	0.2182	0.019	-0.03	0.2996	-0.035	0.2981	72.4329	-61.9523	27.2819
3	4.1298	-1.5417	3.8806	1.6186	-2.6961	5.1161	0.3937	1.0859	0.6654	0.3405	0.2003	-0.1598	0.5328	-0.2615	-0.4045	0.5071	0.2425	0.045	0.4863	0.0746	0.418	68.5561	-7.0893	39.2846
4	1.1191	-0.5001	-0.6415	1.2187	0.3042	1.8108	-0.1997	-0.3296	0.1411	-0.5873	-0.2014	0.3665	0.068	-1.5054	0.5649	0.4709	0.2232	0.234	0.9019	0.0899	0.8177	51.4954	1.4669	35.2552
5	1.4404	0.2151	-0.5153	2.075	-1.1019	2.8688	0.0065	0.1436	-0.0048	-0.2336	0.0297	-0.0268	-0.0567	0.0402	-0.0492	0.4657	0.0159	-0.0247	0.2187	-0.0351	0.2156	84.8462	-15.7325	30.9988
6	2.6277	-2.8756	-1.3326	8.3479	4.5814	5.8952	-0.005	0.4979	0.1513	0.5621	0.0811	-0.4258	0.5657	-0.0427	0.1288	0.4599	-0.0566	0.045	0.4281	0.0722	0.2038	85.1179	-51.6774	44.3646
7	3.0294	0.7628	0.199	5.5937	-0.9529	3.3161	-0.0421	0.1325	-0.0131	-0.0781	0.1427	-0.761	-0.4484	0.6034	-0.1963	0.4984	-0.1186	-0.0059	0.3383	-0.0976	0.3779	104.8205	12.4778	43.5237
8	1.33	0.9005	-0.6243	2.8228	-1.0041	2.3758	0.0265	0.1847	-0.3154	0.1759	-0.0534	-0.4417	0.1723	0.1409	0.1052	0.4588	0.0952	-0.0676	0.2279	0.0356	0.1683	93.2654	-24.4679	51.9409
9	0.8472	0.0513	-0.1695	1.3964	0.0467	0.977	0.0295	-0.1711	0.1032	0.3295	0.0226	-0.0354	-0.2237	-0.0383	-0.0413	0.6032	0.0515	-0.0084	0.312	-0.0267	0.2249	86.5114	-9.4315	53.3322
10	-0.0261	0.3668	0.0758	5.8753	-3.4531	2.5745	-0.0987	-0.0164	0.0412	-0.045	-0.0689	-0.4	-0.1403	0.2136	0.1606	0.2743	0.0492	-0.0302	0.3604	-0.0874	0.2303	80.6595	-41.9395	-5.6284
11	3.0908	0.8125	-1.2872	4.669	0.156	4.4706	0.1175	-0.0972	0.2255	0.3308	0.1439	-0.2972	0.3132	0.2596	-0.1323	0.2396	0.0665	-0.0652	0.3334	-0.0101	0.2185	83.3838	-63.9558	13.739
12	7.2072	-2.7003	5.575	2.5893	-1.0623	5.9606	0.1328	-1.3134	0.0408	-0.0682	0.63	0.3283	0.8243	0.1008	-0.3594	0.4882	-0.063	0.1043	0.5382	-0.1977	0.3129	94.3648	-9.7446	-3.3022
13	2.3696	-0.7805	1.1097	0.35	0.5479	8.2428	0.2267	0.1159	0.267	0.152	-0.0559	-0.8255	0.4254	1.5388	-0.3028	0.4899	0.0157	0.0787	0.6362	-0.0997	0.7994	111.904	-2.4713	0.1021
14	1.1278	0.0089	-0.1916	2.5199	1.1105	2.8137	-0.0539	-0.0484	0.0264	0.2306	0.1174	0.0062	0.0868	-0.03	-0.0401	0.4497	0.051	-0.0366	0.2547	0.0022	0.201	77.7992	-16.7008	5.6912
15	3.7466	1.8435	-0.2803	6.7819	-2.586	3.7407	-0.1742	-0.2625	0.0113	-0.702	0.7125	0.4263	0.8059	-0.409	-0.2865	0.4086	0.0758	-0.0457	0.3352	-0.0232	0.2317	73.6115	-52.9121	-4.5006
16	2.964	0.0979	0.2634	4.1253	-0.9581	3.0197	0.0275	-0.1022	0.1259	0.2167	0.1906	0.334	-0.2484	-0.371	-0.2098	0.417	0.0573	-0.0737	0.2823	0.0981	0.3906	58.8572	11.0802	-9.2108
17	1.7641	-2.2387	-0.3317	3.9732	0.7796	0.8439	-0.354	0.3429	-0.2808	-0.0681	-0.2333	0.9902	0.0288	-0.3433	0.2742	0.5357	-0.0871	-0.1018	0.3608	0.0206	0.1493	68.5949	-26.2951	-14.1018
18	1.1263	-0.3234	0.7685	0.6963	-0.0637	1.0568	0.0567	0.285	0.1739	-0.3153	0.0477	0.0676	-0.0538	0.0004	-0.1666	0.5946	0.0059	-0.0469	0.3596	0.0418	0.2376	76.3664	-12.3325	-17.0101
19	0.9381	0.4534	1.658	3.146	4.8166	8.3912	0.0259	-0.9948	-1.3879	0.7137	0.3583	-0.1736	1.1514	-0.7789	-0.2922	0.6929	0.0313	0.0752	0.6904	0.2971	1.1201	53.5553	-14.9751	22.8773
20	1.9679	-0.0098	-1.264	3.0376	1.1616	2.7408	-0.0225	-0.047	0.4031	0.222	-0.0836	0.0409	-0.7884	-0.5866	0.1136	0.7963	0.3691	0.0958	0.8684	-0.0773	0.5093	59.8232	5.7192	46.4792
21	0.5265	-0.076	0.3774	0.5883	-0.0541	2.7132	-0.1338	-0.0019	0.1612	-0.1298	0.1053	0.3192	-0.4434	-0.5985	0.0392	0.6359	0.3076	-0.0091	0.6903	0.0617	0.5414	57.6787	7.5434	24.0238
22	3.1366	0.3874	2.1523	9.4293	-7.9612	8.6948	-0.4177	0.1821	-0.9619	-0.8249	0.6036	-0.0922	1.5261	1.1369	-0.1871	0.8441	0.2175	-0.0571	0.6635	-0.2059	1.043	109.2718	-17.518	14.1452
23	3.8635	0.3817	-0.0315	6.0556	-1.7184	2.8786	-0.3248	0.9463	-0.1023	-0.7482	0.4063	-0.8882	-0.1465	0.4171	0.1168	0.7354	-0.2773	0.1758	0.7613	-0.0736	0.5841	104.4487	1.8901	-11.5246
24	1.15	0.5434	0.8604	1.0795	0.9196	2.5628	-0.0972	-0.0267	0.1455	0.0542	0.1223	-0.4396	-0.4497	0.4739	0.0305	0.5639	-0.2136	0.0088	0.647	-0.1204	0.6004	106.3091	5.5848	10.4889
25	2.5966	-1.1893	-1.9237	1.7711	-1.2675	4.0046	0.3209	-0.2194	0.5498	-0.2746	0.0084	-0.182	-0.928	0.3526	-0.3857	0.8886	0.0568	0.005	0.4892	-0.1253	0.4598	80.0485	4.605	31.9366
26	2.698	0.8296	-2.3925	0.9655	0.8385	3.5368	0.4291	0.2801	0.444	-0.0375	0.0723	0.0062	-0.9559	-0.1216	-0.4723	0.8608	0.0168	0.006	0.5667	0.0995	0.4257	83.8145	3.1758	2.8967

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 resseq 343:382	A	343 - 382
2	X-RAY DIFFRACTION	2	chain "A" and resseq 383:429	A	383 - 429
3	X-RAY DIFFRACTION	3	chain "A" and resseq 18:30	A	18 - 30
4	X-RAY DIFFRACTION	4	chain "A" and resseq 3:17	A	2 - 17
5	X-RAY DIFFRACTION	5	chain "A" and resseq 31:154	A	31 - 154
6	X-RAY DIFFRACTION	6	chain "A" and resseq 430:455	A	430 - 455
7	X-RAY DIFFRACTION	7	chain "A" and resseq 239:322	A	239 - 322
8	X-RAY DIFFRACTION	8	chain "A" and resseq 456:482	A	456 - 482
9	X-RAY DIFFRACTION	9	chain "A" and not ( resseq 343:382 or resseq 383:429 or resseq 31:154 or resseq 430:455 or resseq 239:322 or resseq 2:17 or resseq 18:30 or resseq 456:482 )	A	155 - 238
10	X-RAY DIFFRACTION	9	chain "A" and not ( resseq 343:382 or resseq 383:429 or resseq 31:154 or resseq 430:455 or resseq 239:322 or resseq 2:17 or resseq 18:30 or resseq 456:482 )	A	323 - 342
11	X-RAY DIFFRACTION	9	chain "A" and not ( resseq 343:382 or resseq 383:429 or resseq 31:154 or resseq 430:455 or resseq 239:322 or resseq 2:17 or resseq 18:30 or resseq 456:482 )	A	483 - 852
12	X-RAY DIFFRACTION	10	chain "B" and resseq 343:382	B	343 - 382
13	X-RAY DIFFRACTION	11	chain "B" and resseq 383:429	B	383 - 429
14	X-RAY DIFFRACTION	12	chain "B" and resseq 18:30	B	18 - 30
15	X-RAY DIFFRACTION	13	chain "B" and resseq 3:17	B	2 - 17
16	X-RAY DIFFRACTION	14	chain "B" and resseq 31:154	B	31 - 154
17	X-RAY DIFFRACTION	15	chain "B" and resseq 430:455	B	430 - 455
18	X-RAY DIFFRACTION	16	chain "B" and resseq 239:322	B	239 - 322
19	X-RAY DIFFRACTION	17	chain "B" and resseq 456:482	B	456 - 482
20	X-RAY DIFFRACTION	18	chain "B" and not ( resseq 343:382 or resseq 383:429 or resseq 31:154 or resseq 430:455 or resseq 239:322 or resseq 2:17 or resseq 18:30 or resseq 456:482 )	B	155 - 238
21	X-RAY DIFFRACTION	18	chain "B" and not ( resseq 343:382 or resseq 383:429 or resseq 31:154 or resseq 430:455 or resseq 239:322 or resseq 2:17 or resseq 18:30 or resseq 456:482 )	B	323 - 342
22	X-RAY DIFFRACTION	18	chain "B" and not ( resseq 343:382 or resseq 383:429 or resseq 31:154 or resseq 430:455 or resseq 239:322 or resseq 2:17 or resseq 18:30 or resseq 456:482 )	B	483 - 840
23	X-RAY DIFFRACTION	19	chain "C" and resseq 539:581	C	539 - 581
24	X-RAY DIFFRACTION	20	chain "C" and resseq 610:634	C	610 - 634
25	X-RAY DIFFRACTION	21	chain "C" and not ( resseq 539:581 or resseq 610:634 )	C	415 - 538
26	X-RAY DIFFRACTION	21	chain "C" and not ( resseq 539:581 or resseq 610:634 )	C	582 - 609
27	X-RAY DIFFRACTION	21	chain "C" and not ( resseq 539:581 or resseq 610:634 )	C	635 - 830
28	X-RAY DIFFRACTION	22	chain "D" and resseq 539:581	D	539 - 581
29	X-RAY DIFFRACTION	23	chain "D" and resseq 610:634	D	610 - 634
30	X-RAY DIFFRACTION	24	chain "D" and not ( resseq 539:581 or resseq 610:634 )	D	415 - 538
31	X-RAY DIFFRACTION	24	chain "D" and not ( resseq 539:581 or resseq 610:634 )	D	582 - 609
32	X-RAY DIFFRACTION	24	chain "D" and not ( resseq 539:581 or resseq 610:634 )	D	635 - 832
33	X-RAY DIFFRACTION	25	chain "E" or chain "F"	E	9 - 15
34	X-RAY DIFFRACTION	26	chain "G" or chain "H"	G	9 - 15

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