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- PDB-9u8s: Crystal structure of thiamine pyrophosphate (TPP)-dependent alpha... -

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Open data

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Basic information

Entry

Database: PDB / ID: 9u8s

Title

Crystal structure of thiamine pyrophosphate (TPP)-dependent alpha-imino acid decarboxylase (AzcB and AzcC) from Streptomyces mobaraensis in complex with TPP and 5-azacytosine.

Components

(Thiamine pyrophosphate enzyme ...) x 2

Keywords

LYASE / thiamine pyrophosphate (TPP)-dependent decarboxylase / AzcB / AzcC / 5-azacytidine biosynthesis / 5-azacytosine

Function / homology

6-amino-1,3,5-triazin-2(1H)-one / THIAMINE DIPHOSPHATE / : / :

Function and homology information

Biological species

Streptomyces mobaraensis (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 2.46 Å

Authors

Nakashima, Y. / Tsunoda, T. / Ogasawara, Y. / Dairi, T. / Morita, H.

Funding support

Japan, 3items

Organization	Grant number	Country
Japan Society for the Promotion of Science (JSPS)	22H04976	Japan
Japan Society for the Promotion of Science (JSPS)	18H03937	Japan
Japan Society for the Promotion of Science (JSPS)	22H05130	Japan

Citation

Journal: To Be Published
Title: Crystal structure of thiamine pyrophosphate (TPP)-dependent decarboxylase (AzcB and AzcC complexes) from Streptomyces mobaraensis in complex with TPP and 5-azacytosine.
Authors: Nakashima, Y. / Morita, H.

History

Deposition	Mar 26, 2025	Deposition site: PDBJ / Processing site: PDBJ
Revision 1.0	Apr 1, 2026	Provider: repository / Type: Initial release

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Structure visualization

Structure viewer	Molecule: MolmilJmol/JSmol

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Downloads & links

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Download

PDBx/mmCIF format	9u8s.cif.gz	992.8 KB	Display	PDBx/mmCIF format
PDB format	pdb9u8s.ent.gz	678.7 KB	Display	PDB format
PDBx/mmJSON format	9u8s.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/u8/9u8s ftp://data.pdbj.org/pub/pdb/validation_reports/u8/9u8s	HTTPS FTP

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Related structure data

Similar structure data	Similarity search - Function & homologyF&H Search Similarity search - HomologyF&H Search

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Links

PDB pages	PDBj / wwPDB / NCBI
Related items in Molecule of the Month	#263 - Nov 2021 Acetohydroxyacid Synthase similarity (1) #153 - Sep 2012 Pyruvate Dehydrogenase Complex similarity (1)

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Assembly

Deposited unit

A: Thiamine pyrophosphate enzyme N-terminal TPP-binding domain-containing protein

B: Thiamine pyrophosphate enzyme N-terminal TPP-binding domain-containing protein

C: Thiamine pyrophosphate enzyme N-terminal TPP-binding domain-containing protein

D: Thiamine pyrophosphate enzyme N-terminal TPP-binding domain-containing protein

E: Thiamine pyrophosphate enzyme N-terminal TPP-binding domain-containing protein

F: Thiamine pyrophosphate enzyme N-terminal TPP-binding domain-containing protein

G: Thiamine pyrophosphate enzyme TPP-binding domain-containing protein

H: Thiamine pyrophosphate enzyme TPP-binding domain-containing protein

I: Thiamine pyrophosphate enzyme TPP-binding domain-containing protein

J: Thiamine pyrophosphate enzyme TPP-binding domain-containing protein

K: Thiamine pyrophosphate enzyme TPP-binding domain-containing protein

L: Thiamine pyrophosphate enzyme TPP-binding domain-containing protein

hetero molecules

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

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

Unit cell

Length a, b, c (Å)	119.465, 96.918, 130.285
Angle α, β, γ (deg.)	90.000, 113.386, 90.000
Int Tables number	4
Space group name H-M	P12₁1
Space group name Hall	P2yb
Symmetry operation	#1: x,y,z #2: -x,y+1/2,-z

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Components

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Thiamine pyrophosphate enzyme ... , 2 types, 12 molecules ABCDEFGHIJKL

#1: Protein	Thiamine pyrophosphate enzyme N-terminal TPP-binding domain-containing protein Mass: 18049.711 Da / Num. of mol.: 6 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Streptomyces mobaraensis (bacteria) / Gene: H7K43_04135 / Production host: Streptomyces lividans (bacteria) / References: UniProt: A0A7X1IDQ3
#2: Protein	Thiamine pyrophosphate enzyme TPP-binding domain-containing protein Mass: 20528.576 Da / Num. of mol.: 6 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Streptomyces mobaraensis (bacteria) / Gene: H7K43_04130 / Production host: Streptomyces lividans (bacteria) / References: UniProt: A0A7X1IDK5

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Non-polymers , 6 types, 905 molecules

#3: Chemical	ChemComp-5AZ / 6-amino-1,3,5-triazin-2(1H)-one / 5-Azacytosine Mass: 112.090 Da / Num. of mol.: 6 / Source method: obtained synthetically / Formula: C₃H₄N₄O / Feature type: SUBJECT OF INVESTIGATION
#4: Chemical	ChemComp-ZN / ZINC ION Mass: 65.409 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: Zn / Feature type: SUBJECT OF INVESTIGATION
#5: Chemical	ChemComp-TPP / THIAMINE DIPHOSPHATE Mass: 425.314 Da / Num. of mol.: 6 / Source method: obtained synthetically / Formula: C₁₂H₁₉N₄O₇P₂S / Feature type: SUBJECT OF INVESTIGATION
#6: Chemical	ChemComp-MG / MAGNESIUM ION Mass: 24.305 Da / Num. of mol.: 6 / Source method: obtained synthetically / Formula: Mg
#7: Chemical	ChemComp-GOL / GLYCEROL / GLYCERIN / PROPANE-1,2,3-TRIOL Mass: 92.094 Da / Num. of mol.: 1 / Source method: obtained synthetically / Formula: C₃H₈O₃ / Feature type: SUBJECT OF INVESTIGATION
#8: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 883 / Source method: isolated from a natural source / Formula: H₂O

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Details

Has ligand of interest	Y
Has protein modification	N

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Experimental details

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Experiment

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

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Sample preparation

Crystal	Density Matthews: 2.99 Å³/Da / Density % sol: 58.87 %
Crystal grow	Temperature: 293 K / Method: vapor diffusion, sitting drop / pH: 7 Details: 3.7 mg/mL AzcB:AzcC, 2 mM TPP, 200 mM Li2SO4, 100 mM Tris/HCl (pH 7.0), 1000 mM potassium sodium tartrate

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Data collection

Diffraction	Mean temperature: 100 K / Serial crystal experiment: N
Diffraction source	Source: SYNCHROTRON / Site: Photon Factory / Beamline: BL-1A / Wavelength: 1.005 Å
Detector	Type: DECTRIS EIGER X 4M / Detector: PIXEL / Date: Mar 10, 2025
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 1.005 Å / Relative weight: 1
Reflection	Resolution: 2.46→48.46 Å / Num. obs: 192138 / % possible obs: 99.9 % / Redundancy: 5.2 % / B_iso Wilson estimate: 26.9 Å² / CC_1/2: 0.988 / R_merge(I) obs: 0.154 / Net I/σ(I): 9.3
Reflection shell	Resolution: 2.46→2.5 Å / Redundancy: 5.3 % / R_merge(I) obs: 0.778 / Mean I/σ(I) obs: 2.1 / Num. unique obs: 4891 / CC_1/2: 0.604 / % possible all: 99.9

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Processing

Software

Name	Version	Classification
PHENIX	1.17.1_3660	refinement
XDS		data reduction
Aimless		data scaling
PHASER		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT / Resolution: 2.46→48.46 Å / SU ML: 0.285 / Cross valid method: FREE R-VALUE / σ(F): 1.33 / Phase error: 22.4348
Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2

	R_factor	Num. reflection	% reflection
R_free	0.2328	3892	2.03 %
R_work	0.19	188246	-
obs	0.1909	192138	98.65 %

Solvent computation

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

Displacement parameters

B_iso mean: 31.18 Å²

Refinement step

Cycle: LAST / Resolution: 2.46→48.46 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	16216	0	30	883	17129

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.0021	16534
X-RAY DIFFRACTION	f_angle_d	0.5529	22559
X-RAY DIFFRACTION	f_chiral_restr	0.0419	2668
X-RAY DIFFRACTION	f_plane_restr	0.0041	2909
X-RAY DIFFRACTION	f_dihedral_angle_d	23.1374	5994

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 (%)
2.46-2.49	0.2461	150	0.2507	6716	X-RAY DIFFRACTION	98.64
2.49-2.52	0.3365	122	0.2551	6707	X-RAY DIFFRACTION	98.78
2.52-2.55	0.2589	172	0.2577	6779	X-RAY DIFFRACTION	98.78
2.55-2.59	0.3139	116	0.2562	6694	X-RAY DIFFRACTION	98.5
2.59-2.63	0.3084	127	0.2576	6698	X-RAY DIFFRACTION	98.77
2.63-2.67	0.344	151	0.2576	6731	X-RAY DIFFRACTION	98.61
2.67-2.71	0.3183	144	0.2518	6767	X-RAY DIFFRACTION	98.84
2.71-2.75	0.2704	141	0.2556	6752	X-RAY DIFFRACTION	98.73
2.75-2.8	0.3262	140	0.2495	6656	X-RAY DIFFRACTION	98.24
2.8-2.85	0.3302	142	0.2499	6703	X-RAY DIFFRACTION	97.95
2.85-2.91	0.2548	130	0.2322	6618	X-RAY DIFFRACTION	97.4
2.91-2.96	0.264	136	0.2263	6627	X-RAY DIFFRACTION	97.1
2.96-3.03	0.2953	144	0.2167	6645	X-RAY DIFFRACTION	97.61
3.03-3.1	0.2618	138	0.2269	6666	X-RAY DIFFRACTION	98.34
3.1-3.18	0.2555	145	0.207	6755	X-RAY DIFFRACTION	99.32
3.18-3.26	0.2062	139	0.2006	6749	X-RAY DIFFRACTION	99.28
3.26-3.36	0.2337	137	0.1895	6821	X-RAY DIFFRACTION	99.33
3.36-3.47	0.2168	137	0.1753	6725	X-RAY DIFFRACTION	99.2
3.47-3.59	0.2215	136	0.1616	6819	X-RAY DIFFRACTION	99.13
3.59-3.73	0.2095	129	0.1577	6784	X-RAY DIFFRACTION	99.08
3.73-3.9	0.2224	136	0.15	6687	X-RAY DIFFRACTION	99.07
3.9-4.11	0.1697	147	0.1463	6755	X-RAY DIFFRACTION	98.91
4.11-4.37	0.1644	147	0.1337	6716	X-RAY DIFFRACTION	99.06
4.37-4.7	0.1986	136	0.1408	6753	X-RAY DIFFRACTION	99.09
4.7-5.18	0.1797	148	0.1497	6756	X-RAY DIFFRACTION	98.95
5.18-5.93	0.2243	139	0.1655	6754	X-RAY DIFFRACTION	98.95
5.93-7.46	0.1877	128	0.177	6780	X-RAY DIFFRACTION	99.21
7.46-48.46	0.2123	135	0.185	6633	X-RAY DIFFRACTION	97.49

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	0.230414384388	-0.0772833431707	-0.0311704358344	0.217212266599	-0.156247318959	0.18476152522	-0.0995289377605	-0.416488458596	0.416486215238	0.388018966997	-0.164894536482	-0.0959516634798	-0.246510740394	-0.0597316092099	-0.0322951889968	0.362942068957	-0.0219847869001	0.0221962952283	0.201044759957	-0.0830726704225	0.278106719371	25.5818498019	40.7298109999	49.5215407876
2	0.082538577723	-0.0572791674475	0.00756928660744	0.0815914325945	0.0299304624388	0.104996863013	0.0633540993318	-0.0367523567043	0.07003409743	0.175895551067	-0.075238774668	-0.0595644517636	0.0278687160629	0.00747189969513	1.0454140295E-6	0.21134397087	-0.0136347461131	0.0266531101108	0.159961313226	-0.0161662814845	0.140559400449	24.6085574466	27.1815571369	41.940863262
3	1.2852258344	0.424696990484	0.356370965139	0.222711696116	0.17564182879	0.161693278908	-0.0102266478954	0.194550338484	0.298921008743	0.00632331524552	-0.108593060606	0.207170950812	0.0154864376065	0.0947563707182	-0.0564048586877	0.186200262594	0.0312482448782	-0.00589753486358	0.138219124948	-0.0101083940244	0.0412039492031	26.9374125091	33.642875993	35.0232834536
4	0.011667177297	0.00513757109222	-0.0112299219726	0.00395646063141	-0.00388733859488	0.00868015256234	-0.0156331724782	0.0956361375777	-0.0376892997539	-0.0705850993549	-0.16591650602	-0.134169192857	-0.0186845721339	0.322236034907	-0.000217351032436	0.538633673142	-0.0452160916153	-0.0398290078688	0.265940648101	0.0685938627745	0.33083531171	35.5625617861	-11.4267656765	44.7391069643
5	0.000746086523811	0.00370701394638	-0.00441066843674	0.0134920800499	-0.0162261520783	0.0114293747515	0.0519482146657	-0.130380597767	0.0687442046534	0.169575675189	-0.0641447403219	0.0801607714281	0.115584683275	0.0148523790411	-1.99330027878E-5	0.203466011468	-0.0355223597641	0.00929254201396	0.134417158923	0.00281093313355	0.157729319073	34.1487540161	-0.326672084809	47.3156211681
6	0.000818962529154	-0.000875494595115	0.000910376906252	0.0049051581981	-0.00964728033201	0.0139220862663	0.0982091693836	-0.0609022727	-0.0679802275017	0.158849756997	0.0922283253699	0.0267563906144	0.157116896603	-0.14059322499	0.000273526069465	0.43920650687	-0.0563222609196	0.0168743009965	0.346221259134	0.065158077712	0.235312980279	29.6950124627	-7.12922551843	51.3407703481
7	0.0671159243119	0.0398646657192	0.0121608250774	0.080016046853	0.025509119864	0.0107003357221	0.00827701317374	-0.10985662668	-0.0805148788996	0.0642767283767	-0.077951808935	-0.0731374930689	0.0388614393209	0.123564718502	0.0256382453187	0.38149012882	0.00879735569439	-0.0373033147925	0.216382859822	0.0893288121714	0.105466561869	36.3358672762	-1.53476821544	53.7679134017
8	0.0851936174279	-0.00179905311726	0.0192150293085	0.0150622112264	0.022379027608	0.0249248439719	-0.00663158038585	-0.136092096004	0.0446905337347	0.0509453716619	-0.0173340816487	-0.0391313732317	-0.0501489553959	-0.0430537050264	-9.07058281049E-6	0.19699311575	0.00816916223018	-0.0260780620116	0.117132789182	0.0128473689251	0.0869206248257	38.2738047043	10.0238302195	43.2676974098
9	0.0191546608085	0.010157874293	0.00492961279113	0.071341740886	0.0492324595552	0.0209363178946	0.0886760590213	-0.0653279143611	-0.0971053849988	0.0181019454633	-0.131311192502	-0.160964028427	-0.125055144757	-0.13056080721	1.04647463091E-5	0.250673653418	0.00225463706768	0.000570524987658	0.240835920616	0.0243548422793	0.170654064796	22.2730860168	8.50471387882	34.8183987067
10	0.0227011160154	0.00420593207349	-0.0174263382152	0.00774223899384	-0.00213878166285	0.00832116062903	0.0301182297923	0.128830359967	-0.164071975052	0.0653466251459	-0.0679193163705	0.154827179061	0.204640515748	0.0198695651838	1.61976647264E-5	0.163773732829	-0.0355227246405	0.024845797836	0.202368107478	-0.0436277566374	0.181018091181	33.9982015453	1.1157473628	31.7582344983
11	0.0667202237357	-0.0544587297847	-0.0299619863138	0.0632632949464	0.0448493859157	0.133027354601	-0.156630531931	-0.0455723736197	-0.122306728833	0.0474662799726	-0.136373032001	-0.123391067947	0.332900339777	0.0747036148646	-0.00908730541763	0.261210049641	0.0654591100636	-0.014575457667	0.220871539781	-0.0168916262912	0.178208972037	41.6959052376	-3.89951248105	35.2007381479
12	0.0949290730293	-0.0957805552682	0.0448425139689	0.0862248935431	-0.0382353769143	0.0223423486416	-0.00618083469039	0.042670630816	0.0340843852455	-0.0819008008748	-0.08029831554	-0.0712076326509	0.221668059813	-0.0370571744305	0.0257020521343	0.25724133601	-0.0413833653122	-0.0297314680968	0.167860156599	-0.0327044211933	0.289461701939	32.5829179221	-0.77406659657	36.5406466717
13	0.18565776135	-0.0507444210141	0.106703212165	0.345969832677	0.0913364387362	0.184379656058	-0.00127978092599	-0.0206841737449	0.219751045853	-0.171544838026	-0.131400824431	-0.0473605560597	-0.111885323155	-0.0499877469171	-0.122001129483	0.127440628648	0.0120017744972	-0.0707062729342	0.0925380273826	-0.00191305065884	0.191343255097	11.4453748872	42.5422416162	5.54497106096
14	0.173978899841	0.104547679826	-0.258892489972	0.0676248265049	-0.152919553504	0.39712284928	0.0452578897687	0.246993472732	0.041330538209	-0.255692872988	-0.202650994523	0.146940925655	-0.0379930912318	-0.286861993874	-0.0768255281303	0.209630236435	0.0433659484087	-0.0652318871785	0.242785557621	0.0234321952125	0.266225390958	7.35471837675	38.6762047196	0.0439437699205
15	0.292190050052	0.0987814250399	0.104948852187	0.279969604144	0.00635346936422	0.0435789092563	-0.074390551722	0.110725844625	0.0800913955406	-0.0113700872266	0.138718576815	0.191043898725	-0.0874407133925	-0.0582812264864	0.0347414070925	0.0633089788343	0.00308117017596	-0.00632287147522	0.0537803016136	0.00274572329412	0.086479220947	16.4640800755	26.31973787	4.15700402897
16	-0.000760437952237	-0.00328438398845	-0.0159206737049	0.0325009448562	0.0369010890463	0.0204021917632	-0.0928678071499	-0.129647238053	-0.0634216413588	0.116088646072	0.122538895284	0.0851399752687	-0.010494582949	0.25888937117	-5.81180360115E-6	0.155399205765	-0.000386218958114	0.00586210717301	0.163248063471	-0.0208968962133	0.209190019852	15.6730265066	28.9119579935	22.580585329
17	0.204892507723	-0.118748827899	-0.050018625708	0.128495865534	-0.0562691153282	0.14390469777	0.0876027233023	-0.0360379000114	0.256735513777	-0.025749795512	0.0102995745905	-0.246961742548	-0.0623820593655	0.0198568974222	0.00996478130549	0.122917676747	-0.0281225731524	-0.0151751065894	0.069914016952	-0.00795278789314	0.163448821887	23.5712312359	37.3597202285	9.23699674988
18	0.0337323641075	0.0158764541619	0.0159127904996	0.0309759769203	-0.0183614530958	0.0344235108479	-0.0373690218357	-0.00819150179648	-0.265012060362	-0.0144134138487	-0.0634305383667	-0.027371679448	0.298021875361	0.133707309919	0.000291086214387	0.211888967754	-0.0103275374276	-0.00525724166245	0.160856735464	-0.00708745063639	0.299631427597	5.89731199203	-10.3469246795	17.1795388484
19	0.0163776063399	0.0223692076287	-0.00611305863534	0.0301970846439	-0.00905224680496	-0.00104338158725	0.0182630310288	-0.10043550552	0.0589848496836	0.114205375031	0.0436842439072	0.0126163886961	0.0686290427572	0.109680406965	3.90029653968E-6	0.151294958445	-0.0179861278734	0.0189636408733	0.148766672707	0.0359962780843	0.180837591235	4.48441306585	1.517500783	13.6556897907
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94	0.215548745269	-0.00884781595528	0.0775558505149	0.104143153642	0.0459229239454	0.09918406453	-0.0726043349886	0.305583765708	0.0738077716187	-0.093724027284	0.118047848579	-0.05065474147	-0.100228989795	0.0373560607381	-0.0320501270764	0.208012271367	-0.0660504115587	0.0631640233208	0.234212419209	-0.00822447350575	0.174761105513	53.2185680035	25.1681263098	-14.173736193
95	0.330722876231	-0.0481903285055	0.283919246081	0.0301767985237	-0.0557148647553	0.240392030125	0.0614347761183	0.266927210725	0.000686012657656	0.00924306972069	-0.0823328105005	0.0210677935863	-0.0638550294019	0.0244364689251	-0.044859477239	0.200169414687	-0.0239277072478	0.0144056371526	0.151134636509	-0.0488031344421	0.168849717437	32.3596927095	9.02957077	-11.3330527316

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details
1	X-RAY DIFFRACTION	1	chain 'A' and (resid 1 through 46 )
2	X-RAY DIFFRACTION	2	chain 'A' and (resid 47 through 105 )
3	X-RAY DIFFRACTION	3	chain 'A' and (resid 106 through 166 )
4	X-RAY DIFFRACTION	4	chain 'B' and (resid 2 through 12 )
5	X-RAY DIFFRACTION	5	chain 'B' and (resid 13 through 26 )
6	X-RAY DIFFRACTION	6	chain 'B' and (resid 27 through 35 )
7	X-RAY DIFFRACTION	7	chain 'B' and (resid 36 through 46 )
8	X-RAY DIFFRACTION	8	chain 'B' and (resid 47 through 96 )
9	X-RAY DIFFRACTION	9	chain 'B' and (resid 97 through 122 )
10	X-RAY DIFFRACTION	10	chain 'B' and (resid 123 through 131 )
11	X-RAY DIFFRACTION	11	chain 'B' and (resid 132 through 148 )
12	X-RAY DIFFRACTION	12	chain 'B' and (resid 149 through 166 )
13	X-RAY DIFFRACTION	13	chain 'C' and (resid 2 through 35 )
14	X-RAY DIFFRACTION	14	chain 'C' and (resid 36 through 46 )
15	X-RAY DIFFRACTION	15	chain 'C' and (resid 47 through 96 )
16	X-RAY DIFFRACTION	16	chain 'C' and (resid 97 through 121 )
17	X-RAY DIFFRACTION	17	chain 'C' and (resid 122 through 166 )
18	X-RAY DIFFRACTION	18	chain 'D' and (resid 1 through 13 )
19	X-RAY DIFFRACTION	19	chain 'D' and (resid 14 through 26 )
20	X-RAY DIFFRACTION	20	chain 'D' and (resid 27 through 35 )
21	X-RAY DIFFRACTION	21	chain 'D' and (resid 36 through 46 )
22	X-RAY DIFFRACTION	22	chain 'D' and (resid 47 through 96 )
23	X-RAY DIFFRACTION	23	chain 'D' and (resid 97 through 121 )
24	X-RAY DIFFRACTION	24	chain 'D' and (resid 122 through 131 )
25	X-RAY DIFFRACTION	25	chain 'D' and (resid 132 through 148 )
26	X-RAY DIFFRACTION	26	chain 'D' and (resid 149 through 166 )
27	X-RAY DIFFRACTION	27	chain 'E' and (resid 2 through 12 )
28	X-RAY DIFFRACTION	28	chain 'E' and (resid 13 through 35 )
29	X-RAY DIFFRACTION	29	chain 'E' and (resid 36 through 46 )
30	X-RAY DIFFRACTION	30	chain 'E' and (resid 47 through 96 )
31	X-RAY DIFFRACTION	31	chain 'E' and (resid 97 through 121 )
32	X-RAY DIFFRACTION	32	chain 'E' and (resid 122 through 134 )
33	X-RAY DIFFRACTION	33	chain 'E' and (resid 135 through 148 )
34	X-RAY DIFFRACTION	34	chain 'E' and (resid 149 through 166 )
35	X-RAY DIFFRACTION	35	chain 'F' and (resid 1 through 13 )
36	X-RAY DIFFRACTION	36	chain 'F' and (resid 14 through 35 )
37	X-RAY DIFFRACTION	37	chain 'F' and (resid 36 through 46 )
38	X-RAY DIFFRACTION	38	chain 'F' and (resid 47 through 96 )
39	X-RAY DIFFRACTION	39	chain 'F' and (resid 97 through 121 )
40	X-RAY DIFFRACTION	40	chain 'F' and (resid 122 through 134 )
41	X-RAY DIFFRACTION	41	chain 'F' and (resid 135 through 148 )
42	X-RAY DIFFRACTION	42	chain 'F' and (resid 149 through 166 )
43	X-RAY DIFFRACTION	43	chain 'G' and (resid 1 through 12 )
44	X-RAY DIFFRACTION	44	chain 'G' and (resid 13 through 34 )
45	X-RAY DIFFRACTION	45	chain 'G' and (resid 35 through 47 )
46	X-RAY DIFFRACTION	46	chain 'G' and (resid 48 through 76 )
47	X-RAY DIFFRACTION	47	chain 'G' and (resid 77 through 89 )
48	X-RAY DIFFRACTION	48	chain 'G' and (resid 90 through 125 )
49	X-RAY DIFFRACTION	49	chain 'G' and (resid 126 through 137 )
50	X-RAY DIFFRACTION	50	chain 'G' and (resid 138 through 152 )
51	X-RAY DIFFRACTION	51	chain 'G' and (resid 153 through 167 )
52	X-RAY DIFFRACTION	52	chain 'G' and (resid 168 through 183 )
53	X-RAY DIFFRACTION	53	chain 'G' and (resid 184 through 194 )
54	X-RAY DIFFRACTION	54	chain 'H' and (resid 1 through 12 )
55	X-RAY DIFFRACTION	55	chain 'H' and (resid 13 through 75 )
56	X-RAY DIFFRACTION	56	chain 'H' and (resid 76 through 86 )
57	X-RAY DIFFRACTION	57	chain 'H' and (resid 87 through 117 )
58	X-RAY DIFFRACTION	58	chain 'H' and (resid 118 through 137 )
59	X-RAY DIFFRACTION	59	chain 'H' and (resid 138 through 167 )
60	X-RAY DIFFRACTION	60	chain 'H' and (resid 168 through 183 )
61	X-RAY DIFFRACTION	61	chain 'H' and (resid 184 through 194 )
62	X-RAY DIFFRACTION	62	chain 'I' and (resid 1 through 25 )
63	X-RAY DIFFRACTION	63	chain 'I' and (resid 26 through 47 )
64	X-RAY DIFFRACTION	64	chain 'I' and (resid 48 through 63 )
65	X-RAY DIFFRACTION	65	chain 'I' and (resid 64 through 106 )
66	X-RAY DIFFRACTION	66	chain 'I' and (resid 107 through 152 )
67	X-RAY DIFFRACTION	67	chain 'I' and (resid 153 through 167 )
68	X-RAY DIFFRACTION	68	chain 'I' and (resid 168 through 194 )
69	X-RAY DIFFRACTION	69	chain 'J' and (resid 1 through 47 )
70	X-RAY DIFFRACTION	70	chain 'J' and (resid 48 through 89 )
71	X-RAY DIFFRACTION	71	chain 'J' and (resid 90 through 106 )
72	X-RAY DIFFRACTION	72	chain 'J' and (resid 107 through 125 )
73	X-RAY DIFFRACTION	73	chain 'J' and (resid 126 through 137 )
74	X-RAY DIFFRACTION	74	chain 'J' and (resid 138 through 152 )
75	X-RAY DIFFRACTION	75	chain 'J' and (resid 153 through 167 )
76	X-RAY DIFFRACTION	76	chain 'J' and (resid 168 through 194 )
77	X-RAY DIFFRACTION	77	chain 'K' and (resid 1 through 12 )
78	X-RAY DIFFRACTION	78	chain 'K' and (resid 13 through 47 )
79	X-RAY DIFFRACTION	79	chain 'K' and (resid 48 through 63 )
80	X-RAY DIFFRACTION	80	chain 'K' and (resid 64 through 89 )
81	X-RAY DIFFRACTION	81	chain 'K' and (resid 90 through 106 )
82	X-RAY DIFFRACTION	82	chain 'K' and (resid 107 through 125 )
83	X-RAY DIFFRACTION	83	chain 'K' and (resid 126 through 137 )
84	X-RAY DIFFRACTION	84	chain 'K' and (resid 138 through 152 )
85	X-RAY DIFFRACTION	85	chain 'K' and (resid 153 through 167 )
86	X-RAY DIFFRACTION	86	chain 'K' and (resid 168 through 194 )
87	X-RAY DIFFRACTION	87	chain 'L' and (resid 1 through 13 )
88	X-RAY DIFFRACTION	88	chain 'L' and (resid 14 through 47 )
89	X-RAY DIFFRACTION	89	chain 'L' and (resid 48 through 63 )
90	X-RAY DIFFRACTION	90	chain 'L' and (resid 64 through 89 )
91	X-RAY DIFFRACTION	91	chain 'L' and (resid 90 through 106 )
92	X-RAY DIFFRACTION	92	chain 'L' and (resid 107 through 125 )
93	X-RAY DIFFRACTION	93	chain 'L' and (resid 126 through 137 )
94	X-RAY DIFFRACTION	94	chain 'L' and (resid 138 through 167 )
95	X-RAY DIFFRACTION	95	chain 'L' and (resid 168 through 194 )

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