PDB-7mpp: Bartonella henselae NrnC cleaving pGG in the presence of Mg2+

ID or keywords:

Entry

Database: PDB / ID: 7mpp

Title

Bartonella henselae NrnC cleaving pGG in the presence of Mg2+

Components

NanoRNase C

Keywords

RNA BINDING PROTEIN / RNase / bacteria / enzyme

Function / homology

Function and homology information

nucleobase-containing compound metabolic process / 3'-5' exonuclease activity / nucleic acid binding
Similarity search - Function

Biological species

Bartonella henselae (bacteria)

Method

X-RAY DIFFRACTION /

SYNCHROTRON /

MOLECULAR REPLACEMENT / Resolution: 2 Å

Authors

Lormand, J.D. / Sondermann, H.

Funding support

United States, 1items

Citation

Journal: Elife / Year: 2021
Title: Structural characterization of NrnC identifies unifying features of dinucleotidases.
Authors: Justin D Lormand / Soo-Kyoung Kim / George A Walters-Marrah / Bryce A Brownfield / J Christopher Fromme / Wade C Winkler / Jonathan R Goodson / Vincent T Lee / Holger Sondermann /

Abstract: RNA degradation is fundamental for cellular homeostasis. The process is carried out by various classes of endolytic and exolytic enzymes that together degrade an RNA polymer to mono-ribonucleotides. ...

History

Deposition	May 4, 2021	Deposition site: RCSB / Processing site: RCSB
Revision 1.0	Sep 15, 2021	Provider: repository / Type: Initial release
Revision 1.1	Sep 29, 2021	Group: Database references / Category: citation / citation_author 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
Revision 1.2	Oct 18, 2023	Group: Data collection / Refinement description Category: chem_comp_atom / chem_comp_bond / pdbx_initial_refinement_model

Structure viewer	Molecule: MolmilJmol/JSmol

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Download

PDBx/mmCIF format	7mpp.cif.gz	839.1 KB	Display	PDBx/mmCIF format
PDB format	pdb7mpp.ent.gz	578.9 KB	Display	PDB format
PDBx/mmJSON format	7mpp.json.gz		Tree view	PDBx/mmJSON format
Others	Other downloads

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Validation report

Summary document	7mpp_validation.pdf.gz	6.1 MB	Display	wwPDB validaton report
Full document	7mpp_full_validation.pdf.gz	6 MB	Display
Data in XML	7mpp_validation.xml.gz	72 KB	Display
Data in CIF	7mpp_validation.cif.gz	99.3 KB	Display
Arichive directory	https://data.pdbj.org/pub/pdb/validation_reports/mp/7mpp ftp://data.pdbj.org/pub/pdb/validation_reports/mp/7mpp	HTTPS FTP

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Related structure data

Related structure data	23941C 23942C 23943C 23944C 23945C 23946C 23947C 23948C 7mplC 7mpmC 7mpnC 7mpoC 7mpqC 7mprC 7mpsC 7mptC 7mpuC 7mqbC 7mqcC 7mqdC 7mqeC 7mqfC 7mqgC 7mqhC 7mqiC 1yt3S C: citing same article (ref.) S: Starting model for refinement
Similar structure data	7mpn-d 7mpm-d 7mqc-d 7mpl-d 7mpq-d 7mqf-d 7mqb-d 7mqe-d 7mpu-1 7mqi-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	#3 - Mar 2000 DNA Polymerase similarity (3) #104 - Aug 2008 Selenocysteine Synthase similarity (1) #151 - Jul 2012 Hypoxanthine-guanine phosphoribosyltransferase similarity (1)

Deposited unit

A: NanoRNase C

C: NanoRNase C

E: NanoRNase C

G: NanoRNase C

I: NanoRNase C

K: NanoRNase C

M: NanoRNase C

O: NanoRNase C

hetero molecules

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

1

Idetical with deposited unit
defined by author&software
Evidence: light scattering

Unit cell

Length a, b, c (Å)	70.929, 126.734, 127.145
Angle α, β, γ (deg.)	90.000, 94.278, 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

#1: Protein	NanoRNase C Mass: 23446.725 Da / Num. of mol.: 8 Source method: isolated from a genetically manipulated source Source: (gene. exp.) Bartonella henselae (bacteria) / Gene: BM1374165_00260 / Production host: Escherichia coli BL21(DE3) (bacteria) / References: UniProt: X5MEI1
#2: Chemical	ChemComp-5GP / GUANOSINE-5'-MONOPHOSPHATE Mass: 363.221 Da / Num. of mol.: 16 / Source method: obtained synthetically / Formula: C₁₀H₁₄N₅O₈P
#3: Chemical	ChemComp-MG / MAGNESIUM ION Mass: 24.305 Da / Num. of mol.: 16 / Source method: obtained synthetically / Formula: Mg
#4: Water	ChemComp-HOH / water Mass: 18.015 Da / Num. of mol.: 1144 / Source method: isolated from a natural source / Formula: H₂O
Has ligand of interest	N

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Experiment

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

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Sample preparation

Crystal	Density Matthews: 3.05 Å³/Da / Density % sol: 59.66 %
Crystal grow	Temperature: 294 K / Method: vapor diffusion, hanging drop / pH: 6.5 Details: 0.1 M Succinic acid; 10% PEG 3,350; 20% xylitol, 5 mM MgCl2 (soak)

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Data collection

Diffraction	Mean temperature: 100 K / Serial crystal experiment: N
Diffraction source	Source: SYNCHROTRON / Site: APS / Beamline: 24-ID-C / Wavelength: 0.9792 Å
Detector	Type: DECTRIS EIGER2 X 16M / Detector: PIXEL / Date: Jul 28, 2019
Radiation	Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelength	Wavelength: 0.9792 Å / Relative weight: 1
Reflection	Resolution: 2→126.8 Å / Num. obs: 148330 / % possible obs: 98.14 % / Redundancy: 4.2 % / B_iso Wilson estimate: 33.48 Å² / CC_1/2: 0.992 / Net I/σ(I): 18.57
Reflection shell	Resolution: 2→2.071 Å / Num. unique obs: 14541 / CC_1/2: 0.444

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Processing

Software

Name	Version	Classification
XDS		data reduction
PHENIX	1.15.2_3472	refinement
pointless		data scaling
Aimless		data scaling
PHENIX		phasing

Refinement

Method to determine structure:

MOLECULAR REPLACEMENT
Starting model: 1yt3

1yt3

Resolution: 2→126.79 Å / SU ML: 0.1962 / Cross valid method: FREE R-VALUE / σ(F): 1.34 / Phase error: 21.2459
Stereochemistry target values: GeoStd + Monomer Library + CDL v1.2

	R_factor	Num. reflection	% reflection
R_free	0.1872	2004	1.35 %
R_work	0.158	146209	-
obs	0.1584	148213	98.09 %

Solvent computation

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

Displacement parameters

B_iso mean: 41.77 Å²

Refinement step

Cycle: LAST / Resolution: 2→126.79 Å

	Protein	Nucleic acid	Ligand	Solvent	Total
Num. atoms	13069	0	400	1144	14613

Refine LS restraints

Refine-ID	Type	Dev ideal	Number
X-RAY DIFFRACTION	f_bond_d	0.0059	13918
X-RAY DIFFRACTION	f_angle_d	0.8279	18946
X-RAY DIFFRACTION	f_chiral_restr	0.0531	2153
X-RAY DIFFRACTION	f_plane_restr	0.0044	2406
X-RAY DIFFRACTION	f_dihedral_angle_d	15.7767	8407

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 (%)
2-2.05	0.3167	138	0.2624	10285	X-RAY DIFFRACTION	96.9
2.05-2.1	0.2795	142	0.252	10158	X-RAY DIFFRACTION	95.49
2.1-2.17	0.2492	155	0.1927	10497	X-RAY DIFFRACTION	99.02
2.17-2.24	0.2333	129	0.1874	10516	X-RAY DIFFRACTION	98.86
2.24-2.32	0.2655	140	0.1961	10286	X-RAY DIFFRACTION	97.06
2.32-2.41	0.2144	156	0.1703	10441	X-RAY DIFFRACTION	98.9
2.41-2.52	0.2209	133	0.1728	10408	X-RAY DIFFRACTION	97.55
2.52-2.65	0.1964	133	0.1632	10547	X-RAY DIFFRACTION	99.29
2.65-2.82	0.1943	156	0.166	10525	X-RAY DIFFRACTION	98.67
2.82-3.04	0.2014	139	0.1737	10535	X-RAY DIFFRACTION	99.45
3.04-3.34	0.2267	147	0.1645	10437	X-RAY DIFFRACTION	97.65
3.34-3.83	0.1594	146	0.1418	10482	X-RAY DIFFRACTION	98.41
3.83-4.82	0.1425	147	0.1172	10419	X-RAY DIFFRACTION	97.54
4.82-126.79	0.1477	143	0.1473	10673	X-RAY DIFFRACTION	98.55

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	3.39454522176	0.19243845105	-1.62307970519	2.99354902654	-1.10124369227	4.01319467235	-0.0338378294754	-0.0707798288055	0.0524305517836	0.371611692875	0.0264337919426	0.351313484703	-0.32595698176	-0.243337188429	0.00471176510782	0.269707209809	0.0779124396692	0.0195120334311	0.235380772635	-0.0120406668661	0.217808408889	-14.3918002335	-7.77772500416	57.332085897
2	0.875577032106	-0.156659504303	0.0858401244106	3.20869751914	-0.088319564921	0.469584248096	0.030764072658	-0.0861183758226	-0.052281933762	0.228580503789	-0.0410779314435	0.183381398574	-0.0909331648587	-0.0995648403615	0.0210434500056	0.254676661801	0.0364080244408	0.0402320167147	0.241419926911	0.00506791074589	0.226282163383	-8.64087100689	-19.8890856939	57.5234546053
3	2.44288889023	1.85313641116	-1.56914909172	9.28513166953	-1.88031303768	7.46481970298	-0.419604998141	0.612965253758	-0.12428111996	-0.26651595288	0.232233670418	-0.0248507360819	-0.346766396613	-0.339853560884	0.213944606086	0.285961657272	0.0487601403368	-0.01839690751	0.391322213558	-0.0227407010462	0.279397865638	-18.3260153778	-9.16076970564	44.5536565897
4	1.24236435564	-0.0361301966613	-0.171165563844	1.80264050064	-0.00682847380654	0.551496739162	-0.0670982438553	-0.0338029903085	-0.0934954148934	0.296103899509	-0.0161902664099	0.069196393051	-0.010052996789	-0.0522826053576	0.0829510617094	0.289964093208	0.028990468695	0.0111441213035	0.228207787587	0.00259674176493	0.209553536353	-2.83321380907	-24.1317809136	59.0995872658
5	1.80215831988	0.821346672385	-0.128490235273	3.49642566302	0.894757121473	2.5760844948	-0.0128394962404	0.0688866329683	-0.107244605	0.177259461869	0.0275626208169	0.14683835596	0.250763069435	-0.317447782322	0.0107665135359	0.244793747097	-0.0287116521997	0.0362283654817	0.28298315384	0.0452442477423	0.333371125664	-13.3362503187	-56.4594390601	52.9125451267
6	0.585258674034	0.0403192074971	0.0588969925527	1.07897253341	0.023925364085	3.95022708585	-0.0285239871499	0.0903711146706	0.0359849045029	0.00484291786929	0.025977141623	0.13288329626	0.0636729794828	-0.258643300446	-0.0128872100177	0.195076296226	-0.0346613710291	0.00611254081063	0.262271125273	0.0285895585879	0.295291998874	-6.89776075831	-56.1322164445	41.5363179106
7	2.36931201335	0.662792905625	0.619525266826	6.65276672142	5.13024708236	5.70777434278	-0.212479287092	0.20837098158	0.519633920274	-0.372625153507	0.0418535342655	0.503197754644	-0.379930190352	-0.364317306532	0.137919755133	0.229307815989	0.000829226621586	-0.0108759453698	0.339951112476	0.086092885259	0.475365842848	-17.9632950372	-47.4629876657	48.4105648564
8	1.56682400071	0.243307121794	1.13723104785	1.50322878171	0.420515792296	3.37828710986	0.0456426263826	-0.0309844723813	-0.0408265721439	0.0170778287566	-0.00675718800484	-0.0538448711825	0.256489029229	-0.146871869425	-0.0466118542897	0.174999745774	0.00459876003146	0.0225920900398	0.205878024875	0.0373352209878	0.258265735507	2.09354817375	-57.6721320535	36.5462906654
9	2.55877716684	-0.863820264872	-0.465466612491	2.06793009816	0.754382802421	2.66498892792	0.0399214626664	0.242399550349	0.0806133600703	-0.437383781914	-0.0655943363778	0.147579623361	-0.522456428463	-0.286038328847	0.0321231880768	0.463887014152	0.0196369943539	-0.103589257824	0.283744537514	-3.23567910878E-5	0.237705822672	-10.8419738904	-3.65038599738	8.73040510099
10	1.08090537894	-0.271935219991	-0.182462983766	0.642521980272	0.43482496776	3.19675550916	0.0231241195341	0.146142339211	-0.010954182568	-0.229222411962	-0.0082638269998	0.121115262355	-0.375438984287	-0.0986289245124	-0.0193322187114	0.314235506599	0.000409646399672	-0.0568620992986	0.210242904926	-0.0184349683462	0.198366548787	-5.89008812543	-3.57506879167	21.2583479062
11	6.82989660342	-0.935889280147	-3.56756462829	5.28485477825	2.55765534682	2.69455563071	-0.238897141387	0.212025976909	-0.625980034676	-0.109523424056	-0.0724389685964	0.482007308216	0.0815381301971	-0.245728951924	0.268495998038	0.384888818767	-0.0445450784154	-0.070186135766	0.317303489112	-0.0326346436961	0.401285681749	-15.8684153771	-15.6978823433	10.7646293729
12	1.48786537169	0.0483224279662	0.0744727820393	0.178506504578	-0.105599708227	1.22376195937	-0.0825271006128	-0.0254505995336	-0.0330214503728	0.0225402005822	0.0457991971802	0.0756287759355	-0.303960656217	0.0255260354887	0.0223493787931	0.413737796045	-0.0158885848728	-0.0364728617368	0.250507843623	0.00237186940612	0.225860727505	-0.746089003101	-2.25623802936	26.2579247648
13	2.09830797842	-1.2600430795	0.765210069599	2.75653733858	-0.135579306488	2.25061345159	-0.180904944729	-0.105014463502	0.0147436772139	0.525259345423	0.08829146958	-0.24139327382	-0.0990004417332	0.204958085261	0.082480585413	0.297967126744	0.00120567621725	-0.113213246485	0.295723529853	0.0837235835501	0.380713834772	25.9187367232	-37.3820005212	68.0463020769
14	1.52460375001	0.567184656961	0.375756784559	4.73539640642	-1.20161372975	1.57777246157	-0.0128543325512	0.108279194447	-0.202045671123	0.059609939046	-0.0852367921371	-0.417050167371	-0.108880007815	0.157304822142	0.118139195323	0.220373417976	0.0144458459214	-0.0609632155716	0.26882668979	0.0346676351141	0.311558274143	22.4248608091	-26.3654566586	57.4883269958
15	6.58691989218	2.74007455702	-1.00027951258	2.14071038044	-0.862419401405	6.27370337618	-0.250644276853	0.648946521833	-0.0264669581433	-0.472249176656	0.186841531292	-0.357335868924	-0.150059133968	0.508310767882	0.0249085875957	0.248807891373	0.0187450506307	-0.0683760488964	0.511982159895	-0.0143129345717	0.517199836508	33.2610841525	-42.179736385	55.1883423911
16	2.16762023651	0.15372886976	0.189595418916	1.93325713741	-0.243104991028	1.06121661087	-0.00984525871364	-0.108731189824	-0.127219071798	0.234310813588	-0.0413762953905	-0.236733972583	-0.198471460134	0.096512995202	0.0513264632383	0.293439330964	-0.00377392714665	-0.0595190143681	0.251557534845	0.0402077032636	0.220988039165	16.168814591	-23.5761909202	60.3652570228
17	2.00402704373	0.386832580044	-0.325596272394	3.15018435577	-0.72651476578	2.3492767038	-0.047408809979	0.0950081694435	-0.00624654867863	-0.617272636257	0.0216614072785	0.267072040288	0.168904458329	-0.127875388919	0.022602596912	0.370436435742	-0.0417835890686	-0.0446197762235	0.254688491328	-0.0387784910059	0.245717759675	-8.18827673412	-51.1628780442	2.77930049681
18	1.45476774895	-0.515858531486	0.910462487371	3.94434361027	-0.897265782856	0.727035688412	-0.0583320466411	-0.199098313665	0.0248103976484	-0.0377096599128	0.0856983011463	0.149822178436	-0.110029313323	-0.0571621850611	-0.0317605760482	0.324038773851	-0.0227801562488	0.0195160958211	0.279501087776	-0.0383146914592	0.23213474828	-5.2028048825	-36.7231853574	8.23490898024
19	5.30990494508	-2.76644218969	0.0692298408045	6.69790640895	-1.03121397314	6.17880224117	-0.204353733283	-0.297959130091	-0.0702295094258	0.403015826087	0.140966760262	0.637081027213	-0.170442582913	-0.29418027948	0.0896970492151	0.223549359212	-0.0524447318977	0.0146696167475	0.490455903393	-0.0227184396795	0.323366099665	-15.6717772012	-50.5236258188	16.4029330377
20	1.28761559303	0.255238378424	0.0514573080535	2.24647898256	0.253051016538	0.0917912294622	-0.0811268935829	-0.0204627899134	-0.0240631212173	-0.503472036215	0.0665013711914	-0.0046449306109	-0.106268544099	-0.0243766337324	0.0213878767487	0.379897914877	-0.0265525591387	0.015484277457	0.315340879717	-0.0543421576621	0.242864179138	1.25618296251	-35.3357399808	4.23664077802
21	2.15943214133	0.0891959031978	-0.462176175638	1.16574409652	-0.155571178491	3.4470855869	-0.092666834461	0.0963001707943	-0.148001740806	-0.163059426513	0.0340407765087	-0.654632879933	0.688383945896	0.407354639373	0.0695639736606	0.348511014509	0.101135763351	0.128673728518	0.410406252806	-0.0195756687965	0.675331144141	30.75939466	-62.7249200687	23.8462326123
22	1.52989998496	-0.0938611799924	-0.122247358687	0.851522197934	0.428244189829	4.10996476051	-0.0604258325427	0.0746789636669	-0.225938445604	-0.103059969336	-0.0228091329813	-0.366297736065	0.527179433004	0.055595989449	0.0639819113386	0.284291627189	0.0406302643521	0.062855337449	0.337508093267	-0.00654304371325	0.530986995973	21.8087846886	-63.7158446451	30.3698288531
23	0.733674448274	-0.18000882149	-1.36822447584	0.581766146665	0.294243584576	4.4518371159	0.105527083951	0.00643239496182	0.267370901192	-0.11047728778	0.0727631935292	-0.579649840114	-0.32822373929	0.590273338634	-0.18459645402	0.257505850263	-0.0134433136528	0.0291662183191	0.487088699702	0.0432038398323	0.756555241366	31.4495691454	-48.5881341795	33.1031857958
24	1.41632046363	-0.264579372542	-0.517614148669	1.64036894781	0.447600834952	1.90478156396	-0.114949031	0.0121427502386	-0.0211964081822	0.159523958779	0.044223038327	-0.504847769133	0.231167109661	0.341309148215	0.0823072785726	0.199566631757	0.025581865952	-0.0130339689128	0.242314379822	0.0250670621379	0.429485337709	19.3705620337	-56.8557954168	38.0639381072
25	2.27312576938	0.393958783764	0.210876950262	1.59012253242	-0.192758206636	2.59494893201	-0.151743149718	-0.0239115725042	0.153046156986	0.0445549213001	0.104996366557	-0.155063076357	-0.500449790238	0.2346594372	0.0340805527055	0.374229793107	-0.0894535068261	-0.0695693257097	0.260744060144	-0.00293999898309	0.22910062226	26.7549384478	5.37757319404	41.4523722266
26	1.7147593909	-0.107613785424	-0.491897255717	1.2789489544	0.840673747233	3.45364367622	-0.0618005174571	-0.0685652657355	-0.121889577512	0.0791267147239	0.0437736609383	-0.192181613325	0.0238114670344	0.261915819571	0.0127651428364	0.267405310308	-0.0735974166006	-0.0289270902778	0.268724638675	-0.00282940836274	0.253444590574	24.2218557596	-5.39982449128	30.4956518051
27	2.27073711999	-1.42151704553	-2.06081938564	3.15744703601	3.23595723121	3.53268367697	-0.316768893349	-0.274097824564	-0.812495877334	-0.027550399473	0.259181299644	-0.0981876231389	0.0656990339369	0.620447367521	0.120660508207	0.36077038908	-0.0279752888836	-0.0771021823359	0.389038665359	0.0846007131604	0.46390257856	32.5872092285	-8.43247520694	48.0087314231
28	1.19795488801	0.00790779593955	0.181778570665	0.531135933105	0.0502869440809	1.02748323909	-0.0950933800989	0.0370833550498	-0.0687805396679	-0.140261032568	0.0192063640368	-0.0851847777637	-0.225525723125	0.129888658982	0.0675348013166	0.362883565362	-0.0713579759919	-0.0163036081922	0.278903320276	-0.0207224660753	0.253584905603	19.4426423833	-2.29418819791	27.9901078884
29	1.70915394626	-0.226309046561	-0.192976254325	1.39658886026	1.12901034777	2.24763146672	-0.381589185001	0.411948603744	-0.255654458498	-0.869636254	0.159281062899	-0.477847663051	-0.191172977764	0.189409749001	0.124339506572	0.594879521692	-0.204837829947	0.30465134853	0.482384643639	-0.0966677726938	0.445028082702	31.4119064832	-19.2403854433	0.101911227034
30	1.99670421408	-0.706880234582	-0.287576186056	3.03501236557	-0.294165197808	0.708032254705	-0.18674185527	0.297114960703	-0.170634915213	-0.725618249188	0.190131286635	-0.373146524627	-0.0269047123622	0.0322306571501	0.0266833136657	0.478878280075	-0.144684721155	0.169315758769	0.401615416933	-0.0896283030156	0.3685433053	23.0258960203	-27.7441396088	0.112589024496
31	0.948816123402	1.92817280372	0.252620483588	3.85445651895	0.338977846658	1.03628919479	0.0487870845017	-0.240649588289	-0.489056946248	0.0384864747586	-0.140880053228	-0.782509935164	-0.0814744405892	0.269908094452	0.074819340052	0.251574035915	-0.0275188431985	0.125567913104	0.5592520076	-0.0217909786524	0.535487572966	33.3181771842	-27.6126846697	14.5347096305
32	1.96321480382	0.160427226066	0.24741928877	1.81903961648	-0.122875989362	1.03632418612	-0.275815640232	-0.00941154068057	-0.289695476629	-0.488283250163	0.182680052452	-0.412200714079	0.131927322583	0.202102895286	0.0909333065395	0.370285036687	-0.0407052563456	0.174766632906	0.324297878925	-0.0483142565868	0.338184869891	20.4596403311	-35.765102848	5.66368743836

Refinement TLS group

ID	Refine-ID	Refine TLS-ID	Selection details
1	X-RAY DIFFRACTION	1	(chain A and resid 1:61)
2	X-RAY DIFFRACTION	2	(chain A and resid 62:131)
3	X-RAY DIFFRACTION	3	(chain A and resid 132:151)
4	X-RAY DIFFRACTION	4	(chain A and resid 152:206)
5	X-RAY DIFFRACTION	5	(chain C and resid 2:60)
6	X-RAY DIFFRACTION	6	(chain C and resid 61:131)
7	X-RAY DIFFRACTION	7	(chain C and resid 132:160)
8	X-RAY DIFFRACTION	8	(chain C and resid 161:206)
9	X-RAY DIFFRACTION	9	(chain E and resid 2:60)
10	X-RAY DIFFRACTION	10	(chain E and resid 61:129)
11	X-RAY DIFFRACTION	11	(chain E and resid 130:151)
12	X-RAY DIFFRACTION	12	(chain E and resid 152:206)
13	X-RAY DIFFRACTION	13	(chain G and resid 2:81)
14	X-RAY DIFFRACTION	14	(chain G and resid 82:130)
15	X-RAY DIFFRACTION	15	(chain G and resid 131:152)
16	X-RAY DIFFRACTION	16	(chain G and resid 153:206)
17	X-RAY DIFFRACTION	17	(chain I and resid 2:81)
18	X-RAY DIFFRACTION	18	(chain I and resid 82:131)
19	X-RAY DIFFRACTION	19	(chain I and resid 132:151)
20	X-RAY DIFFRACTION	20	(chain I and resid 152:206)
21	X-RAY DIFFRACTION	21	(chain K and resid 2:61)
22	X-RAY DIFFRACTION	22	(chain K and resid 62:106)
23	X-RAY DIFFRACTION	23	(chain K and resid 107:148)
24	X-RAY DIFFRACTION	24	(chain K and resid 149:206)
25	X-RAY DIFFRACTION	25	(chain M and resid 3:81)
26	X-RAY DIFFRACTION	26	(chain M and resid 82:131)
27	X-RAY DIFFRACTION	27	(chain M and resid 132:148)
28	X-RAY DIFFRACTION	28	(chain M and resid 149:206)
29	X-RAY DIFFRACTION	29	(chain O and resid 3:65)
30	X-RAY DIFFRACTION	30	(chain O and resid 66:107)
31	X-RAY DIFFRACTION	31	(chain O and resid 108:152)
32	X-RAY DIFFRACTION	32	(chain O and resid 153:206)

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