PDB-6ai6: Crystal structure of SpCas9-NG

ID or keywords:

Entry

Database: PDB / ID: 6ai6

Title

Crystal structure of SpCas9-NG

Components

CRISPR-associated endonuclease Cas9/Csn1
DNA (28-MER)
DNA (8-MER)
RNA (81-MER)

Keywords

HYDROLASE/RNA/DNA / nuclease / HYDROLASE-RNA-DNA complex / HYDROLASE

Function / homology

Function and homology information

maintenance of CRISPR repeat elements / 3'-5' exonuclease activity / DNA endonuclease activity / defense response to virus / Hydrolases; Acting on ester bonds / DNA binding / RNA binding / metal ion binding
Similarity search - Function

Biological species

Streptococcus pyogenes serotype M1 (bacteria)

Streptococcus pyogenes (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 2.7 Å

Authors

Nishimasu, H. / Hirano, S. / Ishitani, R. / Nureki, O.

Citation

Journal: Science / Year: 2018
Title: Engineered CRISPR-Cas9 nuclease with expanded targeting space
Authors: Nishimasu, H. / Shi, X. / Ishiguro, S. / Gao, L. / Hirano, S. / Okazaki, S. / Noda, T. / Abudayyeh, O.O. / Gootenberg, J.S. / Mori, H. / Oura, S. / Holmes, B. / Tanaka, M. / Seki, M. / ...

History

Deposition	Aug 21, 2018	Deposition site: PDBJ / Processing site: PDBJ
Revision 1.0	Oct 31, 2018	Provider: repository / Type: Initial release
Revision 1.1	Nov 22, 2023	Group: Data collection / Database references ...Data collection / Database references / Derived calculations / Refinement description Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_initial_refinement_model / pdbx_struct_conn_angle / struct_conn / struct_conn_type Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession ..._database_2.pdbx_DOI / _database_2.pdbx_database_accession / _pdbx_struct_conn_angle.ptnr1_auth_asym_id / _pdbx_struct_conn_angle.ptnr1_auth_comp_id / _pdbx_struct_conn_angle.ptnr1_auth_seq_id / _pdbx_struct_conn_angle.ptnr1_label_asym_id / _pdbx_struct_conn_angle.ptnr1_label_atom_id / _pdbx_struct_conn_angle.ptnr1_label_comp_id / _pdbx_struct_conn_angle.ptnr1_label_seq_id / _pdbx_struct_conn_angle.ptnr2_auth_asym_id / _pdbx_struct_conn_angle.ptnr2_auth_comp_id / _pdbx_struct_conn_angle.ptnr2_auth_seq_id / _pdbx_struct_conn_angle.ptnr2_label_asym_id / _pdbx_struct_conn_angle.ptnr2_label_atom_id / _pdbx_struct_conn_angle.ptnr2_label_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_asym_id / _pdbx_struct_conn_angle.ptnr3_auth_comp_id / _pdbx_struct_conn_angle.ptnr3_auth_seq_id / _pdbx_struct_conn_angle.ptnr3_label_asym_id / _pdbx_struct_conn_angle.ptnr3_label_atom_id / _pdbx_struct_conn_angle.ptnr3_label_comp_id / _pdbx_struct_conn_angle.ptnr3_label_seq_id / _pdbx_struct_conn_angle.value / _struct_conn.conn_type_id / _struct_conn.id / _struct_conn.pdbx_dist_value / _struct_conn.pdbx_leaving_atom_flag / _struct_conn.ptnr1_auth_asym_id / _struct_conn.ptnr1_auth_comp_id / _struct_conn.ptnr1_auth_seq_id / _struct_conn.ptnr1_label_asym_id / _struct_conn.ptnr1_label_atom_id / _struct_conn.ptnr1_label_comp_id / _struct_conn.ptnr1_label_seq_id / _struct_conn.ptnr2_auth_asym_id / _struct_conn.ptnr2_auth_comp_id / _struct_conn.ptnr2_auth_seq_id / _struct_conn.ptnr2_label_asym_id / _struct_conn.ptnr2_label_atom_id / _struct_conn.ptnr2_label_comp_id / _struct_conn.ptnr2_label_seq_id / _struct_conn_type.id

Structure viewer	Molecule: MolmilJmol/JSmol

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Validation report

Summary document	6ai6_validation.pdf.gz	483.5 KB	Display	wwPDB validaton report
Full document	6ai6_full_validation.pdf.gz	501.2 KB	Display
Data in XML	6ai6_validation.xml.gz	48 KB	Display
Data in CIF	6ai6_validation.cif.gz	66.1 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/ai/6ai6 ftp://data.pdbj.org/pub/pdb/validation_reports/ai/6ai6	HTTPS FTP

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Related structure data

Related structure data	4un3S S: Starting model for refinement
Similar structure data	6k57-d 5fw2-d 5fw3-d 6k4u-d 6k3z-d 6k4q-d 6k4p-d 5b2t-d 5fw1-d 6k4s-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
Related items in Molecule of the Month	#181 - Jan 2015 Cascade and CRISPR similarity (14) #253 - Jan 2021 Expressome similarity (2) #121 - Jan 2010 70S Ribosomes similarity (1) #16 - Apr 2001 Aminoacyl-tRNA Synthetases similarity (1) #130 - Oct 2010 Riboswitches similarity (1) #157 - Jan 2013 Transfer-Messenger RNA similarity (1) #67 - Jul 2005 TATA-Binding Protein similarity (1) #229 - Jan 2019 Fluorescent RNA Aptamers similarity (1) #168 - Dec 2013 DNA Helicase similarity (1) #87 - Mar 2007 Zinc Fingers similarity (2) #91 - Jul 2007 Thymine Dimers similarity (1) #260 - Aug 2021 Ribonuclease P similarity (1) #255 - Mar 2021 Cisplatin and DNA similarity (1) #249 - Sep 2020 SARS-CoV-2 RNA-dependent RNA Polymerase similarity (1) #146 - Feb 2012 Aminoglycoside Antibiotics similarity (1) #172 - Apr 2014 RecA and Rad51 similarity (1) #227 - Nov 2018 Telomerase similarity (2) #122 - Feb 2010 Enhanceosome similarity (1) #15 - Mar 2001 Transfer RNA similarity (1) #84 - Dec 2006 Transposase similarity (1) #48 - Dec 2003 Catabolite Activator Protein similarity (1) #10 - Oct 2000 Ribosome similarity (1) #210 - Jun 2017 Adenine Riboswitch in Action similarity (1) #150 - Jun 2012 Sliding Clamps similarity (1) #135 - Mar 2011 Integrase similarity (1) #112 - Apr 2009 Oct and Sox Transcription Factors similarity (1) #180 - Dec 2014 TAL Effectors similarity (1) #65 - May 2005 Self-splicing RNA similarity (1) #105 - Sep 2008 Ribonuclease A similarity (1) #226 - Oct 2018 Aminoglycoside Antibiotics and Resistance similarity (1) #245 - May 2020 Spliceosomes similarity (1) #262 - Oct 2021 Fifty Years of Open Access to PDB Structures similarity (1) #98 - Feb 2008 Small Interfering RNA similarity (1) #73 - Jan 2006 Topoisomerase similarity (1) #40 - Apr 2003 RNA Polymerase similarity (1) #139 - Jul 2011 DNA Methyltransferase similarity (1) #155 - Nov 2012 Vitamin D Receptor similarity (1) #3 - Mar 2000 DNA Polymerase similarity (1) #161 - May 2013 Ricin similarity (1) #89 - May 2007 Aconitase and Iron Regulatory Protein 1 similarity (1) #81 - Sep 2006 Elongation Factors similarity (1) #119 - Nov 2009 Designed DNA Crystal similarity (1) #266 - Feb 2022 Oligosaccharyltransferase similarity (1) #125 - May 2010 Parvoviruses similarity (1) #131 - Nov 2010 Inteins similarity (1) #230 - Feb 2019 Initiation Factor eIF4E similarity (1) #160 - Apr 2013 Actinomycin similarity (1) #190 - Oct 2015 Two-component Systems similarity (1) #23 - Nov 2001 DNA similarity (1) #7 - Jul 2000 Nucleosome similarity (1) #240 - Dec 2019 Hypoxia-Inducible Factors similarity (1) #8 - Aug 2000 Restriction Enzymes similarity (1) #257 - May 2021 Fetal Hemoglobin similarity (1) #258 - Jun 2021 Glucocorticoid Receptor and Dexamethasone similarity (1) #143 - Nov 2011 Toll-like Receptors similarity (1) #31 - Jul 2002 p53 Tumor Suppressor similarity (1) #106 - Oct 2008 Poly(A) Polymerase similarity (1) #33 - Sep 2002 HIV Reverse Transcriptase similarity (1) #104 - Aug 2008 Selenocysteine Synthase similarity (1) #39 - Mar 2003 lac Repressor similarity (1) #92 - Aug 2007 Anabolic Steroids similarity (1) #45 - Sep 2003 Estrogen Receptor similarity (1) #55 - Jul 2004 DNA Ligase similarity (1) #241 - Jan 2020 Twenty Years of Molecules similarity (2)

PDB pages

PDBj /

wwPDB /

NCBI

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Deposited unit

A: CRISPR-associated endonuclease Cas9/Csn1

B: RNA (81-MER)

C: DNA (28-MER)

D: DNA (8-MER)

hetero molecules

197 kDa, 4 polymers
Search similar-shape structures of this assembly by Omokage search (details)

1

Idetical with deposited unit
defined by author&software
Evidence: gel filtration

Unit cell

Length a, b, c (Å)	177.377, 68.568, 187.968
Angle α, β, γ (deg.)	90.00, 111.51, 90.00
Int Tables number	5
Space group name H-M	C121

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DNA chain , 2 types, 2 molecules CD

#3: DNA chain	DNA (28-MER) Mass: 8463.485 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) Streptococcus pyogenes (bacteria)
#4: DNA chain	DNA (8-MER) Mass: 2472.638 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) Streptococcus pyogenes (bacteria)

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Protein / RNA chain , 2 types, 2 molecules AB

#1: Protein	CRISPR-associated endonuclease Cas9/Csn1 / SpCas9 / SpyCas9 Mass: 159226.516 Da / Num. of mol.: 1 Mutation: N863A, L1111R, D1135V, G1218R, E1219F, A1322R, R1355V, T1357R Source method: isolated from a genetically manipulated source Source: (gene. exp.) Streptococcus pyogenes serotype M1 (bacteria) Gene: cas9, csn1, SPy_1046 / Production host: Escherichia coli (E. coli) References: UniProt: Q99ZW2, Hydrolases; Acting on ester bonds
#2: RNA chain	RNA (81-MER) Mass: 26209.588 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.) Streptococcus pyogenes (bacteria)

#1: Protein

CRISPR-associated endonuclease Cas9/Csn1 / SpCas9 / SpyCas9

Mass: 159226.516 Da / Num. of mol.: 1
Mutation: N863A, L1111R, D1135V, G1218R, E1219F, A1322R, R1355V, T1357R
Source method: isolated from a genetically manipulated source
Source: (gene. exp.)

Streptococcus pyogenes serotype M1 (bacteria)
Gene: cas9, csn1, SPy_1046 / Production host:

Escherichia coli (E. coli)
References: UniProt: Q99ZW2, Hydrolases; Acting on ester bonds

#2: RNA chain

RNA (81-MER)

Mass: 26209.588 Da / Num. of mol.: 1 / Source method: obtained synthetically / Source: (synth.)

Streptococcus pyogenes (bacteria)

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Non-polymers , 4 types, 52 molecules

#5: Chemical	ChemComp-K / POTASSIUM ION Mass: 39.098 Da / Num. of mol.: 10 / Source method: obtained synthetically / Formula: K
#6: Chemical	ChemComp-MG / MAGNESIUM ION Mass: 24.305 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: Mg
#7: Chemical	ChemComp-EDO / 1,2-ETHANEDIOL / ETHYLENE GLYCOL Mass: 62.068 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: C₂H₆O₂
#8: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 36 / 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: 2.71 Å³/Da / Density % sol: 54.58 %
Crystal grow	Temperature: 293 K / Method: vapor diffusion, hanging drop / pH: 8 / Details: Tris-acetate, pH 8.0, KSCN, PEG 3350

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Data collection

Diffraction	Mean temperature: 100 K
Diffraction source	Source: SYNCHROTRON / Site: SPring-8 / Beamline: BL41XU / Wavelength: 1 Å
Detector	Type: DECTRIS EIGER X 16M / Detector: PIXEL / Date: Jun 8, 2018
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 1 Å / Relative weight: 1
Reflection	Resolution: 2.7→48.17 Å / Num. obs: 58235 / % possible obs: 100 % / Redundancy: 3.5 % / CC_1/2: 0.992 / R_merge(I) obs: 0.099 / R_pim(I) all: 0.063 / Net I/σ(I): 9.5
Reflection shell	Resolution: 2.7→2.77 Å / R_merge(I) obs: 1.202 / Num. unique obs: 4509 / CC_1/2: 0.553 / R_pim(I) all: 0.778

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Processing

Software

Name	Version	Classification
PHENIX	(1.13_2998: ???)	refinement
Aimless		data scaling
XDS		data reduction
MOLREP		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: 4UN3

4un3

Resolution: 2.7→48.166 Å / SU ML: 0.38 / Cross valid method: FREE R-VALUE / σ(F): 1.33 / Phase error: 28.96

	R_factor	Num. reflection	% reflection
R_free	0.2435	2891	4.98 %
R_work	0.218	-	-
obs	0.2193	58087	99.7 %

Solvent computation

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

Refinement step

Cycle: LAST / Resolution: 2.7→48.166 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	10535	2464	25	36	13060

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.002	13496
X-RAY DIFFRACTION	f_angle_d	0.452	18765
X-RAY DIFFRACTION	f_dihedral_angle_d	16.444	7846
X-RAY DIFFRACTION	f_chiral_restr	0.035	2178
X-RAY DIFFRACTION	f_plane_restr	0.003	1979

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 (%)
2.7-2.7443	0.3665	122	0.3346	2636	X-RAY DIFFRACTION	100
2.7443-2.7916	0.3736	126	0.3283	2598	X-RAY DIFFRACTION	99
2.7916-2.8423	0.378	149	0.3254	2585	X-RAY DIFFRACTION	99
2.8423-2.897	0.407	128	0.3514	2623	X-RAY DIFFRACTION	100
2.897-2.9561	0.3981	134	0.3359	2600	X-RAY DIFFRACTION	100
2.9561-3.0204	0.3305	143	0.3081	2592	X-RAY DIFFRACTION	100
3.0204-3.0906	0.2993	115	0.2912	2661	X-RAY DIFFRACTION	100
3.0906-3.1679	0.3259	118	0.2756	2626	X-RAY DIFFRACTION	99
3.1679-3.2536	0.3004	154	0.257	2568	X-RAY DIFFRACTION	99
3.2536-3.3493	0.2564	145	0.2519	2577	X-RAY DIFFRACTION	99
3.3493-3.4574	0.2791	144	0.2528	2612	X-RAY DIFFRACTION	99
3.4574-3.5809	0.2707	139	0.2338	2622	X-RAY DIFFRACTION	100
3.5809-3.7242	0.2618	151	0.2181	2591	X-RAY DIFFRACTION	100
3.7242-3.8936	0.2433	136	0.1969	2625	X-RAY DIFFRACTION	100
3.8936-4.0988	0.2074	146	0.1973	2639	X-RAY DIFFRACTION	100
4.0988-4.3555	0.2029	133	0.1866	2645	X-RAY DIFFRACTION	100
4.3555-4.6915	0.2031	152	0.1754	2626	X-RAY DIFFRACTION	100
4.6915-5.1631	0.2082	128	0.1713	2654	X-RAY DIFFRACTION	100
5.1631-5.9091	0.1952	145	0.1853	2676	X-RAY DIFFRACTION	100
5.9091-7.4404	0.2138	147	0.2053	2677	X-RAY DIFFRACTION	100
7.4404-48.1741	0.2138	136	0.1879	2763	X-RAY DIFFRACTION	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	0.4226	-0.0778	0.2073	0.3215	-0.0947	1.4206	-0.0185	0.1066	-0.0406	0.1055	-0.0199	-0.1079	0.1021	0.4626	0.0264	0.4429	-0.0645	0.0208	0.5083	-0.0435	0.4453	12.1578	5.4104	47.3659
2	2.7355	1.3511	-0.1454	3.0535	-1.1696	4.1118	-0.0627	-0.1846	-0.0449	0.9432	0.1105	-0.3091	-0.8778	-0.0907	-0.0394	0.7853	0.103	-0.0854	0.3374	-0.0357	0.6464	-3.4755	20.3909	77.929
3	2.6861	-1.217	1.4073	1.3937	-0.5941	2.4095	0.2535	0.1555	-0.611	0.1855	-0.0575	-0.2891	0.8135	0.3606	-0.1868	0.9134	-0.0298	-0.0472	0.6814	-0.1115	0.8843	-8.5633	-15.3552	63.06
4	1.5766	0.2449	-0.4287	0.6835	-0.1302	1.8222	-0.0485	-0.0337	-0.2491	0.166	0.082	-0.0185	0.4886	-0.3246	-0.0221	0.609	-0.1897	0.0275	0.589	-0.0644	0.551	-28.3622	-12.2289	44.1364
5	1.093	-0.6721	-2.0673	0.4776	0.7313	7.4321	-0.3806	0.0851	-0.012	0.2659	0.3577	0.0971	1.1129	-0.6738	0.0478	0.6469	-0.1555	0.1299	0.6578	-0.1252	0.5572	-5.2967	6.2683	59.347
6	1.8486	0.2503	0.626	3.1303	0.5864	3.6076	0.1352	0.3916	0.0385	-0.1759	0.0781	-0.5059	0.9103	0.6227	-0.2071	0.5433	0.0425	0.0685	0.8215	-0.1024	0.4583	16.4024	-1.6371	17.5035
7	1.8883	-0.7132	-0.3329	2.5545	0.2534	4.2494	1.3138	1.577	-0.0622	-1.243	-0.2949	0.16	0.9783	0.517	-1.0773	1.8276	0.474	-0.0598	1.6359	-0.1794	0.7676	22.5479	-17.9468	2.2729
8	2.5327	0.048	0.7195	0.8672	-0.1436	1.762	0.1018	0.1347	0.0932	-0.1083	-0.1419	0.1214	0.0636	0.0794	0.0447	0.3101	-0.0817	0.0033	0.3507	-0.0178	0.269	-2.9441	9.3923	29.8222
9	0.5995	-0.2972	1.456	0.1694	-0.7893	4.2101	-0.6373	0.8778	1.276	-0.4288	0.1317	-0.725	-1.3874	1.6241	0.5303	1.6384	-0.3939	0.7384	1.4451	0.3075	2.2275	-35.1442	18.2977	32.6891
10	3.7505	-0.1465	0.0843	2.6003	1.5263	1.1433	0.5878	-2.1799	1.3115	-0.3287	-0.0087	-1.1162	-0.7999	1.2787	-0.6095	1.3653	0.2471	0.1271	1.859	-0.4113	1.0983	-40.1748	11.9424	39.6068
11	5.1999	1.0165	-2.3119	9.1918	1.1628	1.9174	0.1931	0.7471	-1.4218	-0.3162	0.4163	-0.9619	-0.0744	-0.2707	-0.5641	1.386	-0.5572	0.0576	1.4466	-0.4869	1.2706	-16.123	-20.7294	18.2963
12	5.6612	-0.8411	-1.3978	2.7467	-2.335	2.99	0.296	0.1146	-0.6915	0.0739	-0.8501	0.5288	0.5892	0.3272	0.5444	0.4675	0.0191	0.053	0.9161	-0.1977	0.671	-2.4957	-9.8418	31.0091
13	8.0733	-1.7482	-0.5066	1.9488	-2.9544	6.1232	0.232	-0.4353	0.2908	0.2247	0.288	-0.1441	0.443	-1.2729	-0.5318	0.5823	0.0248	0.1006	0.6235	-0.0279	0.3707	5.9947	4.0681	49.306
14	1.9518	-1.3051	1.1067	7.389	-1.4025	4.0534	0.0813	-0.8439	0.1496	-0.8341	0.529	0.0658	0.2106	0.2567	-0.6104	0.7912	-0.3407	0.2217	0.7788	-0.1789	0.5249	-8.0135	10.3379	60.5748
15	6.113	-1.4746	-0.463	8.4626	4.114	9.1683	-0.6762	0.5603	-0.0821	0.7763	0.9346	1.422	1.2223	-0.9712	-0.2161	0.8665	-0.1511	0.0474	0.8889	0.1375	0.6404	-13.0416	-1.1043	74.9685
16	2.0936	-1.4881	-1.5169	3.4172	3.4168	3.4174	-1.1052	-0.4125	0.6081	1.0727	0.8038	0.5714	-0.4451	-1.617	0.2686	0.8776	0.2534	0.2095	1.0358	0.114	1.0032	-19.3696	8.9873	84.0703
17	2.419	-1.2759	1.5423	5.0247	0.0815	3.4623	0.3628	1.0322	-1.5226	-1.5127	0.0966	-0.6554	0.6707	0.3665	-0.494	1.0116	-0.2828	0.1959	1.0672	-0.4897	1.033	-11.5692	-14.8422	20.0432

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details
1	X-RAY DIFFRACTION	1	chain 'A' and (resid 3 through 560 )
2	X-RAY DIFFRACTION	2	chain 'A' and (resid 561 through 730 )
3	X-RAY DIFFRACTION	3	chain 'A' and (resid 731 through 889 )
4	X-RAY DIFFRACTION	4	chain 'A' and (resid 890 through 1366 )
5	X-RAY DIFFRACTION	5	chain 'B' and (resid 1 through 20 )
6	X-RAY DIFFRACTION	6	chain 'B' and (resid 21 through 30 )
7	X-RAY DIFFRACTION	7	chain 'B' and (resid 31 through 40 )
8	X-RAY DIFFRACTION	8	chain 'B' and (resid 41 through 70 )
9	X-RAY DIFFRACTION	9	chain 'B' and (resid 71 through 75 )
10	X-RAY DIFFRACTION	10	chain 'B' and (resid 76 through 81 )
11	X-RAY DIFFRACTION	11	chain 'C' and (resid 1 through 5 )
12	X-RAY DIFFRACTION	12	chain 'C' and (resid 6 through 10 )
13	X-RAY DIFFRACTION	13	chain 'C' and (resid 11 through 15 )
14	X-RAY DIFFRACTION	14	chain 'C' and (resid 16 through 20 )
15	X-RAY DIFFRACTION	15	chain 'C' and (resid 21 through 25 )
16	X-RAY DIFFRACTION	16	chain 'C' and (resid 26 through 28 )
17	X-RAY DIFFRACTION	17	chain 'D' and (resid 5 through 12 )

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