PDB-4yfb: Structure of N-acylhomoserine lactone acylase MacQ in complex wit...

ID or keywords:

Entry

Database: PDB / ID: 4yfb

Title

Structure of N-acylhomoserine lactone acylase MacQ in complex with phenylacetic acid

Components

(Protein related to penicillin ...) x 3

Keywords

HYDROLASE / Acylase / product complex / Ntn-hydrolase fold

Function / homology

Function and homology information

hydrolase activity, acting on carbon-nitrogen (but not peptide) bonds, in linear amides / antibiotic biosynthetic process
Similarity search - Function

Biological species

Acidovorax sp. MR-S7 (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 1.75 Å

Authors

Yasutake, Y. / Kusada, H. / Kimura, N.

Citation

Journal: Sci Rep / Year: 2017
Title: Bifunctional quorum-quenching and antibiotic-acylase MacQ forms a 170-kDa capsule-shaped molecule containing spacer polypeptides
Authors: Yasutake, Y. / Kusada, H. / Ebuchi, T. / Hanada, S. / Kamagata, Y. / Tamura, T. / Kimura, N.

History

Deposition	Feb 25, 2015	Deposition site: RCSB / Processing site: PDBJ
Revision 1.0	Mar 2, 2016	Provider: repository / Type: Initial release
Revision 1.1	Aug 30, 2017	Group: Data collection / Database references / Derived calculations Category: citation / citation_author ...citation / citation_author / diffrn_source / pdbx_struct_oper_list Item: _citation.country / _citation.journal_abbrev ..._citation.country / _citation.journal_abbrev / _citation.journal_id_CSD / _citation.journal_id_ISSN / _citation.journal_volume / _citation.page_first / _citation.page_last / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title / _citation.year / _diffrn_source.pdbx_synchrotron_site / _pdbx_struct_oper_list.symmetry_operation
Revision 1.2	Nov 8, 2023	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
Revision 1.3	Nov 13, 2024	Group: Structure summary / Category: pdbx_entry_details / pdbx_modification_feature

Structure viewer	Molecule: MolmilJmol/JSmol

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Validation report

Summary document	4yfb_validation.pdf.gz	558.1 KB	Display	wwPDB validaton report
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Data in XML	4yfb_validation.xml.gz	130.9 KB	Display
Data in CIF	4yfb_validation.cif.gz	190.6 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/yf/4yfb ftp://data.pdbj.org/pub/pdb/validation_reports/yf/4yfb	HTTPS FTP

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Related structure data

Related structure data	4yf9C 4yfaC 5c9iC 2wybS C: citing same article (ref.) S: Starting model for refinement
Similar structure data	4yf9-2 4yf9-1 5c9i-1 4yfa-1 4yfa-2 5c9i-2 6l7g-d 4m75-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	#166 - Oct 2013 Proteasome similarity (1) #80 - Aug 2006 AAA+ Proteases similarity (1) #261 - Sep 2021 DNA-Sequencing Nanopores similarity (1) #176 - Aug 2014 Dynein similarity (1) #60 - Dec 2004 Ubiquitin 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)

PDB pages

PDBj /

wwPDB /

NCBI

Related items in Molecule of the Month

#166 - Oct 2013
Proteasome
similarity (1)
#80 - Aug 2006
AAA+ Proteases
similarity (1)
#261 - Sep 2021
DNA-Sequencing Nanopores
similarity (1)
#176 - Aug 2014
Dynein
similarity (1)
#60 - Dec 2004
Ubiquitin
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: Protein related to penicillin acylase

B: Protein related to penicillin acylase

C: Protein related to penicillin acylase

D: Protein related to penicillin acylase

E: Protein related to penicillin acylase

F: Protein related to penicillin acylase

G: Protein related to penicillin acylase

H: Protein related to penicillin acylase

I: Protein related to penicillin acylase

J: Protein related to penicillin acylase

K: Protein related to penicillin acylase

L: Protein related to penicillin acylase

hetero molecules

339 kDa, 12 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

A: Protein related to penicillin acylase

B: Protein related to penicillin acylase

C: Protein related to penicillin acylase

D: Protein related to penicillin acylase

E: Protein related to penicillin acylase

F: Protein related to penicillin acylase

hetero molecules

defined by author
169 kDa, 6 polymers
Search similar-shape structures of this assembly by Omokage search (details)

2

G: Protein related to penicillin acylase

H: Protein related to penicillin acylase

I: Protein related to penicillin acylase

J: Protein related to penicillin acylase

K: Protein related to penicillin acylase

L: Protein related to penicillin acylase

hetero molecules

defined by author
169 kDa, 6 polymers
Search similar-shape structures of this assembly by Omokage search (details)

Unit cell

Length a, b, c (Å)	102.472, 139.026, 122.001
Angle α, β, γ (deg.)	90.00, 111.06, 90.00
Int Tables number	4
Space group name H-M	P12₁1

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Protein related to penicillin ... , 3 types, 12 molecules ADGJBEHKCFIL

#1: Protein	Protein related to penicillin acylase / N-Acyl-L-homoserine lactone acylase / MacQ Mass: 19231.340 Da / Num. of mol.: 4 / Fragment: alpha-chain, UNP residues 29-206 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Acidovorax sp. MR-S7 (bacteria) / Gene: AVS7_00617 / Plasmid: pET19b / Production host: Escherichia coli BL21(DE3) (bacteria) / Strain (production host): BL21(DE3) / References: UniProt: A0A0A1VBK6
#2: Protein/peptide	Protein related to penicillin acylase / N-Acyl-L-homoserine lactone acylase / MacQ Mass: 2653.900 Da / Num. of mol.: 4 / Fragment: spacer peptide, UNP residues 207-233 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Acidovorax sp. MR-S7 (bacteria) / Gene: AVS7_00617 / Plasmid: pET19b / Production host: Escherichia coli BL21(DE3) (bacteria) / Strain (production host): BL21(DE3) / References: UniProt: A0A0A1VBK6
#3: Protein	Protein related to penicillin acylase / N-Acyl-L-homoserine lactone acylase / MacQ Mass: 62611.613 Da / Num. of mol.: 4 / Fragment: beta-chain, UNP residues 234-806 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Acidovorax sp. MR-S7 (bacteria) / Gene: AVS7_00617 / Plasmid: pET19b / Production host: Escherichia coli BL21(DE3) (bacteria) / Strain (production host): BL21(DE3) / References: UniProt: A0A0A1VBK6

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Non-polymers , 3 types, 2409 molecules

#4: Chemical	ChemComp-PAC / 2-PHENYLACETIC ACID Mass: 136.148 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: C₈H₈O₂
#5: Chemical	ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL Mass: 92.094 Da / Num. of mol.: 4 / Source method: obtained synthetically / Formula: C₃H₈O₃
#6: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 2401 / Source method: isolated from a natural source / Formula: H₂O

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Details

Has protein modification	Y

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Experiment

Experiment	Method: X-RAY DIFFRACTION

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Sample preparation

Crystal	Density Matthews: 2.42 Å³/Da / Density % sol: 49.2 %
Crystal grow	Temperature: 293 K / Method: vapor diffusion, hanging drop / Details: Tris-HCl, calcium acetate, PEG 3350 / PH range: 7.5-8.5

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: Photon Factory / Beamline: AR-NE3A / Wavelength: 1 Å
Detector	Type: ADSC QUANTUM 270 / Detector: CCD / Date: Jun 6, 2012
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 1 Å / Relative weight: 1
Reflection	Resolution: 1.75→50 Å / Num. obs: 319483 / % possible obs: 99.9 % / Redundancy: 3.8 % / R_merge(I) obs: 0.081 / Net I/σ(I): 16.29
Reflection shell	Resolution: 1.75→1.78 Å / Redundancy: 3.7 % / R_merge(I) obs: 0.539 / Mean I/σ(I) obs: 3.18 / % possible all: 99.7

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Processing

Software

Name	Version	Classification
REFMAC	5.6.0117	refinement
HKL-2000		data reduction
HKL-2000		data scaling
PHASER		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: PDB code, 2WYB

2wyb

Resolution: 1.75→25.14 Å / Cor.coef. F_o:F_c: 0.967 / Cor.coef. F_o:F_c free: 0.955 / SU B: 3.815 / SU ML: 0.063 / Cross valid method: THROUGHOUT / ESU R: 0.102 / ESU R Free: 0.1 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT

	R_factor	Num. reflection	% reflection	Selection details
R_free	0.19344	16060	5 %	RANDOM
R_work	0.16055	-	-	-
obs	0.16221	303343	99.84 %	-

Solvent computation

Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK

Displacement parameters

B_iso mean: 21.298 Å²

	B_aniso -1	B_aniso -2	B_aniso -3
1-	-0.42 Å²	0 Å²	-0.44 Å²
2-	-	0.33 Å²	0 Å²
3-	-	-	-0.22 Å²

Refinement step

Cycle: LAST / Resolution: 1.75→25.14 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	23038	0	64	2401	25503

Refine LS restraints

Refine-ID	Type	Dev ideal	Dev ideal target	Number
X-RAY DIFFRACTION	r_bond_refined_d	0.021	0.019	23794
X-RAY DIFFRACTION	r_bond_other_d
X-RAY DIFFRACTION	r_angle_refined_deg	1.962	1.931	32401
X-RAY DIFFRACTION	r_angle_other_deg
X-RAY DIFFRACTION	r_dihedral_angle_1_deg	6.648	5	3037
X-RAY DIFFRACTION	r_dihedral_angle_2_deg	34.843	23.004	1092
X-RAY DIFFRACTION	r_dihedral_angle_3_deg	13.249	15	3414
X-RAY DIFFRACTION	r_dihedral_angle_4_deg	16.916	15	196
X-RAY DIFFRACTION	r_chiral_restr	0.156	0.2	3449
X-RAY DIFFRACTION	r_gen_planes_refined	0.013	0.021	18784
X-RAY DIFFRACTION	r_gen_planes_other
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
X-RAY DIFFRACTION	r_mcbond_other
X-RAY DIFFRACTION	r_mcangle_it
X-RAY DIFFRACTION	r_mcangle_other
X-RAY DIFFRACTION	r_scbond_it
X-RAY DIFFRACTION	r_scbond_other
X-RAY DIFFRACTION	r_scangle_it
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

LS refinement shell

Resolution: 1.75→1.795 Å / Total num. of bins used: 20

	R_factor	Num. reflection	% reflection
R_free	0.303	1206	-
R_work	0.25	21994	-
obs	-	-	99.48 %

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	1.2446	0.6255	0.1494	1.4585	0.2594	0.9297	-0.0217	-0.1243	-0.0609	0.0803	-0.0313	0.0502	0.104	-0.1524	0.0531	0.0184	-0.0141	0.0159	0.0495	-0.0111	0.0217	17.2616	-0.4815	75.9524
2	3.4375	1.3173	0.6187	5.6291	1.0328	1.8826	0.0368	0.0513	-0.3875	0.0642	0.0128	-0.2357	0.4089	0.067	-0.0496	0.1443	0.0213	-0.0172	0.0731	0.0297	0.0739	28.6244	-11.7764	81.0559
3	0.7774	-0.0401	-0.0321	1.4618	0.8662	1.6197	-0.0051	-0.1129	-0.1	0.0259	-0.0636	0.042	0.1042	-0.2094	0.0687	0.0303	-0.0355	0.0045	0.067	0.0024	0.0408	14.6892	-3.9258	76.7004
4	9.0388	0.0529	0.0185	2.5548	-4.0293	6.3869	-0.1354	0.1441	-0.7246	-0.3692	0.1112	-0.0227	0.5045	-0.341	0.0242	0.4684	-0.0009	-0.0161	0.503	-0.1361	0.4332	6.6822	-20.9197	45.0978
5	14.7281	13.3305	16.3184	12.1179	14.8058	18.1075	0.1038	-0.2149	-0.3901	-0.314	0.0452	-0.2776	-0.2698	-0.2574	-0.1489	0.8461	-0.1117	-0.1762	0.3799	-0.0574	0.477	17.5993	-8.6912	53.9791
6	0.6442	-0.0171	-0.0744	0.8896	0.1001	0.7802	-0.0304	-0.0766	-0.146	0.0835	-0.0329	0.0282	0.2057	-0.0265	0.0633	0.0614	-0.0047	0.0114	0.0143	0.0069	0.0597	25.9149	-10.0865	64.9447
7	0.5821	0.1476	-0.0522	1.6713	-0.3178	0.877	-0.0119	0.085	-0.0954	-0.0449	-0.0048	0.0211	0.1592	0.0241	0.0168	0.0434	0.0152	0.0077	0.0276	-0.0222	0.0432	33.1855	-10.0366	49.9831
8	0.5378	0.0248	0.4147	0.2507	0.0024	1.4605	0.001	0.0397	0.0708	-0.0419	0.0063	-0.0092	-0.0958	-0.1023	-0.0073	0.026	0.0099	-0.0007	0.0194	0.0077	0.0547	20.3532	12.4359	49.0738
9	1.1258	-0.6447	-0.1399	1.6323	-0.2968	0.6529	-0.0349	0.0739	-0.0562	-0.1335	-0.0533	-0.1105	0.2	0.0882	0.0882	0.0709	0.0163	0.0229	0.0334	0.013	0.0281	-14.2278	1.4083	38.0115
10	1.536	0.4412	-0.179	1.2637	-0.5	1.4566	-0.0436	0.1643	-0.1683	-0.1766	-0.0201	-0.0289	0.2497	0.0235	0.0637	0.1053	0.0246	0.0093	0.0362	-0.0126	0.0247	-16.4428	-0.7387	32.2288
11	5.554	-3.2464	-0.8355	8.7456	0.368	1.0092	-0.0441	-0.1213	0.0204	0.0327	-0.0319	-0.434	0.2702	0.2008	0.076	0.1934	0.0604	0.0547	0.0513	0.0449	0.0942	-10.7967	-16.5144	49.7219
12	13.6556	-0.0109	1.1751	5.3634	2.1141	8.127	0.1696	-0.1503	-0.6319	0.7531	-0.1707	-0.3729	-0.1409	0.4047	0.0011	0.4905	-0.0061	0.0436	0.3353	-0.0064	0.2987	-4.6269	-20.3702	67.4169
13	11.8387	-21.1192	4.7699	37.7013	-8.5135	1.9265	-0.8086	-0.4082	-0.3819	1.7057	0.847	0.5977	-0.3841	-0.1251	-0.0383	0.5771	0.0649	-0.0811	0.5091	0.005	0.4526	-15.5155	-7.6311	59.1569
14	0.5457	0.007	-0.2166	0.8945	-0.0725	0.6951	-0.067	0.0041	-0.1435	-0.0703	-0.0088	-0.0056	0.2572	-0.009	0.0759	0.1067	-0.0119	0.0121	0.0111	0.0106	0.0563	-25.3917	-10.4233	52.5702
15	1.4868	0.2691	0.6028	0.225	0.2673	1.0627	-0.0363	-0.2021	0.0657	0.0598	0.0154	-0.0036	-0.0508	0.075	0.0209	0.0458	-0.0038	-0.0045	0.091	-0.0094	0.0301	-17.3116	11.3732	76.9881
16	1.0402	-0.0533	0.1405	0.5379	-0.4215	2.0463	0.0145	0.0041	0.0729	-0.0116	-0.0282	-0.0281	-0.0876	0.1144	0.0137	0.0089	-0.0063	-0.0059	0.0074	0.0056	0.0307	-19.8491	16.0636	50.4786
17	1.0909	-0.3247	-0.2122	1.4689	-0.2617	1.0631	-0.0296	0.0069	-0.0093	-0.0353	0.035	-0.1757	-0.0298	0.2856	-0.0054	0.0249	0.0154	-0.0011	0.1762	-0.0176	0.0386	59.756	-30.0864	0.9104
18	1.3842	-0.2348	1.126	3.4	-0.8747	8.0866	0.0325	0.0906	0.1142	-0.0833	0.0893	0.2487	-0.23	-0.2296	-0.1218	0.037	0.0244	-0.0149	0.0898	0.0281	0.0752	38.8401	-18.7983	-3.8199
19	1.1616	-0.4245	-0.2902	1.0026	0.4279	1.2542	0.0082	0.0579	0.1792	-0.0388	0.0378	-0.0454	-0.2408	0.12	-0.0461	0.0651	-0.0251	-0.0022	0.1151	0.0209	0.0654	51.7675	-16.9984	-1.1439
20	16.0936	2.3666	5.1502	18.4523	0.2313	11.1345	-0.236	0.722	1.0359	-0.3432	0.0584	0.3393	-0.6848	-0.4181	0.1776	0.2691	0.0409	-0.0299	0.2307	-0.0119	0.3439	20.5778	-2.3477	14.4689
21	18.7854	-16.8888	1.3574	15.1965	-1.2233	0.0989	0.2697	0.3487	-0.192	-0.2249	-0.2662	0.2316	0.018	0.014	-0.0035	0.274	0.0318	-0.0029	0.2385	-0.0148	0.3889	33.2803	-15.099	14.0644
22	0.5157	0.0349	-0.1423	0.8975	0.0906	0.6689	0.0641	-0.0249	0.1548	0.0073	-0.0212	-0.0091	-0.1948	0.1352	-0.043	0.074	-0.0171	0.0085	0.1113	-0.0055	0.0842	47.5731	-13.0171	17.6474
23	1.8929	0.5231	0.2074	0.3004	-0.0876	0.7842	0.0387	-0.1195	0.0289	0.0348	0.0119	0.0713	-0.0106	-0.0434	-0.0506	0.0762	0.0267	-0.0093	0.0502	0.0243	0.0401	25.2775	-35.3359	28.0759
24	1.2188	0.1632	-0.5109	0.4466	-0.1102	1.2716	-0.0463	0.0551	-0.1334	-0.041	0.0088	-0.0445	0.1405	0.0955	0.0376	0.0571	0.04	-0.0113	0.0564	0.003	0.0517	45.8908	-39.471	11.476
25	0.9289	0.2876	-0.0596	1.37	0.4002	1.0534	0.0257	-0.096	-0.023	0.1341	-0.0379	0.0274	-0.0856	0.0296	0.0122	0.0406	-0.0008	-0.0033	0.0316	0.0051	0.0077	1.5173	-25.9645	1.3681
26	1.6238	-0.0871	0.173	0.9322	-0.6583	1.7194	-0.0084	-0.1181	0.018	0.1063	0.0042	0.0735	-0.1455	-0.0912	0.0042	0.034	0.0123	0.0007	0.0306	-0.0182	0.0333	-4.5916	-24.6553	3.9214
27	4.5181	3.4114	1.7667	8.902	3.0853	5.3147	0.1253	-0.1215	-0.0888	0.0806	0.0477	-0.4905	-0.3709	0.306	-0.173	0.1534	-0.0318	-0.0008	0.0348	-0.0004	0.0452	11.3019	-8.0026	-3.7349
28	8.1662	-5.2087	5.8316	20.6844	7.009	10.8195	0.0174	0.2795	0.1472	0.231	0.0904	-0.5752	-0.0016	0.3589	-0.1078	0.3537	-0.0973	-0.0905	0.4836	-0.0457	0.3281	28.5938	-2.2598	-12.134
29	14.4954	18.1951	2.8747	25.5536	3.3814	0.5977	-0.2001	0.0064	-0.028	-0.5201	0.115	-0.9883	-0.0314	0.0556	0.0851	0.2526	-0.0788	0.0353	0.4634	-0.0141	0.3488	16.7902	-16.6507	-13.3885
30	0.5606	-0.0397	-0.2054	0.9048	-0.0412	0.7034	0.0648	0.0644	0.0782	0.0425	-0.0345	0.0341	-0.2029	-0.0187	-0.0304	0.0687	0.0176	-0.0027	0.0361	-0.0045	0.0378	3.7643	-13.5511	-16.1338
31	1.4952	-0.0934	-0.436	0.2491	0.1236	0.5876	-0.0121	0.0206	-0.0925	-0.0038	-0.0295	0.0049	-0.0247	0.0397	0.0416	0.0217	0.0058	-0.0253	0.0152	-0.0105	0.038	19.5143	-36.3155	-20.9971

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Auth asym-ID	Auth seq-ID
1	X-RAY DIFFRACTION	1	A	11 - 96
2	X-RAY DIFFRACTION	2	A	97 - 115
3	X-RAY DIFFRACTION	3	A	116 - 178
4	X-RAY DIFFRACTION	4	B	8 - 14
5	X-RAY DIFFRACTION	5	B	15 - 22
6	X-RAY DIFFRACTION	6	C	1 - 210
7	X-RAY DIFFRACTION	7	C	211 - 337
8	X-RAY DIFFRACTION	8	C	338 - 575
9	X-RAY DIFFRACTION	9	D	11 - 95
10	X-RAY DIFFRACTION	10	D	96 - 159
11	X-RAY DIFFRACTION	11	D	160 - 178
12	X-RAY DIFFRACTION	12	E	8 - 15
13	X-RAY DIFFRACTION	13	E	16 - 21
14	X-RAY DIFFRACTION	14	F	1 - 303
15	X-RAY DIFFRACTION	15	F	304 - 460
16	X-RAY DIFFRACTION	16	F	461 - 575
17	X-RAY DIFFRACTION	17	G	8 - 60
18	X-RAY DIFFRACTION	18	G	61 - 83
19	X-RAY DIFFRACTION	19	G	84 - 178
20	X-RAY DIFFRACTION	20	H	8 - 13
21	X-RAY DIFFRACTION	21	H	14 - 22
22	X-RAY DIFFRACTION	22	I	1 - 297
23	X-RAY DIFFRACTION	23	I	298 - 456
24	X-RAY DIFFRACTION	24	I	457 - 575
25	X-RAY DIFFRACTION	25	J	12 - 96
26	X-RAY DIFFRACTION	26	J	97 - 158
27	X-RAY DIFFRACTION	27	J	159 - 178
28	X-RAY DIFFRACTION	28	K	8 - 14
29	X-RAY DIFFRACTION	29	K	15 - 23
30	X-RAY DIFFRACTION	30	L	1 - 300
31	X-RAY DIFFRACTION	31	L	301 - 574

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