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- PDB-6ryl: WUS-HD bound to TAAT DNA -

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Basic information

Entry
Database: PDB / ID: 6ryl
TitleWUS-HD bound to TAAT DNA
Components
  • DNA (5'-D(P*CP*AP*CP*AP*AP*CP*CP*CP*AP*TP*TP*AP*AP*CP*AP*C)-3')
  • DNA (5'-D(P*GP*TP*GP*TP*TP*AP*AP*TP*GP*GP*GP*TP*TP*GP*TP*G)-3')
  • Protein WUSCHEL
KeywordsDNA BINDING PROTEIN / Homeodomain Transcription factor
Function / homology
Function and homology information


stomium development / anther development / axillary shoot meristem initiation / stem cell population maintenance / cell differentiation / transcription cis-regulatory region binding / DNA-binding transcription factor activity / regulation of DNA-templated transcription / nucleus
Similarity search - Function
Protein WUSCHEL-like / Homeodomain / 'Homeobox' domain profile. / Homeodomain / Homeobox domain / Homeobox-like domain superfamily
Similarity search - Domain/homology
DNA / DNA (> 10) / Protein WUSCHEL
Similarity search - Component
Biological speciesArabidopsis thaliana (thale cress)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 2.63 Å
AuthorsSloan, J.J. / Wild, K. / Sinning, I.
Funding support Germany, 1items
OrganizationGrant numberCountry
German Research Foundation Germany
CitationJournal: Nat Commun / Year: 2020
Title: Structural basis for the complex DNA binding behavior of the plant stem cell regulator WUSCHEL.
Authors: Sloan, J. / Hakenjos, J.P. / Gebert, M. / Ermakova, O. / Gumiero, A. / Stier, G. / Wild, K. / Sinning, I. / Lohmann, J.U.
History
DepositionJun 10, 2019Deposition site: PDBE / Processing site: PDBE
Revision 1.0Apr 29, 2020Provider: repository / Type: Initial release
Revision 1.1May 20, 2020Group: Database references / Category: citation / citation_author
Item: _citation.journal_volume / _citation.page_first ..._citation.journal_volume / _citation.page_first / _citation.page_last / _citation.pdbx_database_id_DOI / _citation.pdbx_database_id_PubMed / _citation.title
Revision 1.2Jan 24, 2024Group: 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

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: Protein WUSCHEL
B: Protein WUSCHEL
C: Protein WUSCHEL
D: Protein WUSCHEL
E: Protein WUSCHEL
F: DNA (5'-D(P*CP*AP*CP*AP*AP*CP*CP*CP*AP*TP*TP*AP*AP*CP*AP*C)-3')
G: DNA (5'-D(P*GP*TP*GP*TP*TP*AP*AP*TP*GP*GP*GP*TP*TP*GP*TP*G)-3')
H: DNA (5'-D(P*CP*AP*CP*AP*AP*CP*CP*CP*AP*TP*TP*AP*AP*CP*AP*C)-3')
I: DNA (5'-D(P*GP*TP*GP*TP*TP*AP*AP*TP*GP*GP*GP*TP*TP*GP*TP*G)-3')


Theoretical massNumber of molelcules
Total (without water)64,3379
Polymers64,3379
Non-polymers00
Water00
1
A: Protein WUSCHEL
B: Protein WUSCHEL
C: Protein WUSCHEL
F: DNA (5'-D(P*CP*AP*CP*AP*AP*CP*CP*CP*AP*TP*TP*AP*AP*CP*AP*C)-3')
G: DNA (5'-D(P*GP*TP*GP*TP*TP*AP*AP*TP*GP*GP*GP*TP*TP*GP*TP*G)-3')


Theoretical massNumber of molelcules
Total (without water)36,6435
Polymers36,6435
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
2
D: Protein WUSCHEL
E: Protein WUSCHEL
H: DNA (5'-D(P*CP*AP*CP*AP*AP*CP*CP*CP*AP*TP*TP*AP*AP*CP*AP*C)-3')
I: DNA (5'-D(P*GP*TP*GP*TP*TP*AP*AP*TP*GP*GP*GP*TP*TP*GP*TP*G)-3')


Theoretical massNumber of molelcules
Total (without water)27,6944
Polymers27,6944
Non-polymers00
Water0
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)82.663, 45.914, 87.535
Angle α, β, γ (deg.)90.000, 102.880, 90.000
Int Tables number4
Space group name H-MP1211
Noncrystallographic symmetry (NCS)NCS domain:
IDEns-IDDetails
11(chain I and (resseq 2:13 or resseq 15:16))
21(chain G and (resseq 2:13 or resseq 15:16))
12(chain A and (resseq 39:43 or resseq 45:46 or resseq...
22(chain B and (resseq 39:43 or resseq 45:46 or resseq...
32(chain C and (resseq 39:43 or resseq 45:46 or resseq...
42(chain D and (resseq 39:43 or resseq 45:46 or resseq...
52(chain E and (resseq 39:43 or resseq 45:46 or resseq...
13(chain F and (resseq 1:8 or (resid 9 and (name...
23(chain H and (resseq 1:8 or (resid 9 and (name...

NCS domain segments:
Dom-IDComponent-IDEns-IDSelection detailsAuth asym-IDAuth seq-ID
111(chain I and (resseq 2:13 or resseq 15:16))I2 - 13
121(chain I and (resseq 2:13 or resseq 15:16))I15 - 16
211(chain G and (resseq 2:13 or resseq 15:16))G2 - 13
221(chain G and (resseq 2:13 or resseq 15:16))G15 - 16
112(chain A and (resseq 39:43 or resseq 45:46 or resseq...A39 - 43
122(chain A and (resseq 39:43 or resseq 45:46 or resseq...A45 - 46
132(chain A and (resseq 39:43 or resseq 45:46 or resseq...A1
142(chain A and (resseq 39:43 or resseq 45:46 or resseq...A73
152(chain A and (resseq 39:43 or resseq 45:46 or resseq...A76
162(chain A and (resseq 39:43 or resseq 45:46 or resseq...A76 - 77
172(chain A and (resseq 39:43 or resseq 45:46 or resseq...A80 - 88
182(chain A and (resseq 39:43 or resseq 45:46 or resseq...A90 - 93
192(chain A and (resseq 39:43 or resseq 45:46 or resseq...A95
212(chain B and (resseq 39:43 or resseq 45:46 or resseq...B39 - 43
222(chain B and (resseq 39:43 or resseq 45:46 or resseq...B45 - 46
232(chain B and (resseq 39:43 or resseq 45:46 or resseq...B48 - 66
242(chain B and (resseq 39:43 or resseq 45:46 or resseq...B69 - 71
252(chain B and (resseq 39:43 or resseq 45:46 or resseq...B73
262(chain B and (resseq 39:43 or resseq 45:46 or resseq...B76 - 77
272(chain B and (resseq 39:43 or resseq 45:46 or resseq...B80 - 88
282(chain B and (resseq 39:43 or resseq 45:46 or resseq...B90 - 93
292(chain B and (resseq 39:43 or resseq 45:46 or resseq...B95
312(chain C and (resseq 39:43 or resseq 45:46 or resseq...C39 - 43
322(chain C and (resseq 39:43 or resseq 45:46 or resseq...C45 - 46
332(chain C and (resseq 39:43 or resseq 45:46 or resseq...C48 - 66
342(chain C and (resseq 39:43 or resseq 45:46 or resseq...C69 - 71
352(chain C and (resseq 39:43 or resseq 45:46 or resseq...C73
362(chain C and (resseq 39:43 or resseq 45:46 or resseq...C76 - 77
372(chain C and (resseq 39:43 or resseq 45:46 or resseq...C80 - 88
382(chain C and (resseq 39:43 or resseq 45:46 or resseq...C90 - 93
392(chain C and (resseq 39:43 or resseq 45:46 or resseq...C95
412(chain D and (resseq 39:43 or resseq 45:46 or resseq...D39 - 43
422(chain D and (resseq 39:43 or resseq 45:46 or resseq...D45 - 46
432(chain D and (resseq 39:43 or resseq 45:46 or resseq...D48 - 66
442(chain D and (resseq 39:43 or resseq 45:46 or resseq...D69 - 71
452(chain D and (resseq 39:43 or resseq 45:46 or resseq...D73
462(chain D and (resseq 39:43 or resseq 45:46 or resseq...D76 - 77
472(chain D and (resseq 39:43 or resseq 45:46 or resseq...D80 - 88
482(chain D and (resseq 39:43 or resseq 45:46 or resseq...D90 - 93
492(chain D and (resseq 39:43 or resseq 45:46 or resseq...D95
512(chain E and (resseq 39:43 or resseq 45:46 or resseq...E39 - 43
522(chain E and (resseq 39:43 or resseq 45:46 or resseq...E45 - 46
532(chain E and (resseq 39:43 or resseq 45:46 or resseq...E48 - 66
542(chain E and (resseq 39:43 or resseq 45:46 or resseq...E69 - 71
552(chain E and (resseq 39:43 or resseq 45:46 or resseq...E73
562(chain E and (resseq 39:43 or resseq 45:46 or resseq...E76 - 77
572(chain E and (resseq 39:43 or resseq 45:46 or resseq...E80 - 88
582(chain E and (resseq 39:43 or resseq 45:46 or resseq...E90 - 93
592(chain E and (resseq 39:43 or resseq 45:46 or resseq...E95
113(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 8
123(chain F and (resseq 1:8 or (resid 9 and (name...F9
133(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
143(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
153(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
163(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
173(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
183(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
193(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
1103(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
1113(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
1123(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
1133(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
1143(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
1153(chain F and (resseq 1:8 or (resid 9 and (name...F1 - 16
213(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 8
223(chain H and (resseq 1:8 or (resid 9 and (name...H9
233(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
243(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
253(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
263(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
273(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
283(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
293(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
2103(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
2113(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
2123(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
2133(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
2143(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
2153(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16
2163(chain H and (resseq 1:8 or (resid 9 and (name...H1 - 16

NCS ensembles :
ID
1
2
3

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Components

#1: Protein
Protein WUSCHEL / AtWUS / Plant growth activator 6


Mass: 8949.188 Da / Num. of mol.: 5
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Arabidopsis thaliana (thale cress) / Gene: WUS, PGA6, At2g17950, T27K22.18 / Production host: Escherichia coli (E. coli) / References: UniProt: Q9SB92
#2: DNA chain DNA (5'-D(P*CP*AP*CP*AP*AP*CP*CP*CP*AP*TP*TP*AP*AP*CP*AP*C)-3')


Mass: 4780.148 Da / Num. of mol.: 2 / Source method: obtained synthetically / Source: (synth.) Arabidopsis thaliana (thale cress)
#3: DNA chain DNA (5'-D(P*GP*TP*GP*TP*TP*AP*AP*TP*GP*GP*GP*TP*TP*GP*TP*G)-3')


Mass: 5015.247 Da / Num. of mol.: 2 / Source method: obtained synthetically / Source: (synth.) Arabidopsis thaliana (thale cress)

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Experimental details

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Experiment

ExperimentMethod: X-RAY DIFFRACTION / Number of used crystals: 1

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Sample preparation

CrystalDensity Matthews: 2.75 Å3/Da / Density % sol: 55.29 %
Crystal growTemperature: 291 K / Method: vapor diffusion, sitting drop / Details: 0.1 M CHES (pH 9.5), 20% PEG 8000

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: ESRF / Beamline: ID23-1 / Wavelength: 0.97242 Å
DetectorType: DECTRIS PILATUS 6M / Detector: PIXEL / Date: Sep 18, 2017
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.97242 Å / Relative weight: 1
ReflectionResolution: 2.63→45.92 Å / Num. obs: 19403 / % possible obs: 99.38 % / Redundancy: 4.5 % / Rpim(I) all: 0.03845 / Net I/σ(I): 11.6
Reflection shellResolution: 2.63→2.724 Å / Num. unique obs: 1907 / CC1/2: 0.552

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Processing

Software
NameVersionClassification
PHENIX1.10.1_2155refinement
PDB_EXTRACT3.24data extraction
XDSdata reduction
Aimlessdata scaling
PHASERphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT
Starting model: 6RY3

6ry3


Resolution: 2.63→41.752 Å / SU ML: 0.45 / Cross valid method: THROUGHOUT / σ(F): 1.34 / Phase error: 33.23
RfactorNum. reflection% reflection
Rfree0.2636 985 5.1 %
Rwork0.2372 --
obs0.2385 19330 99.41 %
Solvent computationShrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å
Displacement parametersBiso max: 229.69 Å2 / Biso mean: 105.5645 Å2 / Biso min: 43.09 Å2
Refinement stepCycle: final / Resolution: 2.63→41.752 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms2735 1312 0 0 4047
Num. residues----380
Refine LS restraints
Refine-IDTypeDev idealNumber
X-RAY DIFFRACTIONf_bond_d0.0044270
X-RAY DIFFRACTIONf_angle_d0.7366015
X-RAY DIFFRACTIONf_chiral_restr0.045642
X-RAY DIFFRACTIONf_plane_restr0.003539
X-RAY DIFFRACTIONf_dihedral_angle_d25.3312342
Refine LS restraints NCS
Ens-IDDom-IDAuth asym-IDNumberRefine-IDRmsType
11I268X-RAY DIFFRACTION18.241TORSIONAL
12G268X-RAY DIFFRACTION18.241TORSIONAL
21A967X-RAY DIFFRACTION18.241TORSIONAL
22B967X-RAY DIFFRACTION18.241TORSIONAL
23C967X-RAY DIFFRACTION18.241TORSIONAL
24D967X-RAY DIFFRACTION18.241TORSIONAL
25E967X-RAY DIFFRACTION18.241TORSIONAL
31F314X-RAY DIFFRACTION18.241TORSIONAL
32H314X-RAY DIFFRACTION18.241TORSIONAL
LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Rfactor Rfree error: 0 / Total num. of bins used: 7

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkNum. reflection all% reflection obs (%)
2.6301-2.76870.39241560.36362556271299
2.7687-2.94210.37921410.335926032744100
2.9421-3.16920.34971200.309526172737100
3.1692-3.4880.30291550.25772570272598
3.488-3.99240.27031310.241526342765100
3.9924-5.02860.23131230.21726642787100
5.0286-41.75770.23031590.2072701286099
Refinement TLS params.

Method: refined / Refine-ID: X-RAY DIFFRACTION

IDL11 (°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)
13.50770.8773-0.80783.76080.44652.2439-0.1811-0.16271.74630.1380.26321.3182-0.8778-1.8757-0.24820.79510.3307-0.17511.6341-0.11461.2849-34.349412.8845-10.1882
24.21672.1385-1.04973.4353-0.96132.6288-0.0464-1.9756-0.71421.13950.0873-1.15570.9024-0.38920.24111.41240.189-0.17841.80110.14391.2345-33.564110.70040.1219
32.63390.84281.37975.4354-2.99262.8872-0.56450.0752-0.3837-0.92790.4632-0.57360.568-1.9497-0.23680.74990.1433-0.21661.2059-0.21861.1601-28.41686.4377-14.9991
43.956-1.592-1.40694.04020.09445.109-0.1633-0.2124-0.3838-0.2492-0.18270.67740.1383-0.36360.36630.6095-0.07560.03230.571-0.01710.5806-9.9401-5.84154.1466
54.2414-0.02890.47795.1941-1.88456.26180.4132-0.5615-0.09480.0388-0.02260.578-0.0295-0.0985-0.33480.53620.06540.02050.52720.0190.6242-13.1401-2.95021.235
69.2342-2.8603-0.41496.98622.01294.9818-0.07310.0864-0.8939-0.8269-0.00480.0605-0.43120.24130.01490.67240.1416-0.01410.5350.0920.5056-3.131511.7075-25.1087
75.99631.22653.42176.1435-1.19498.152-0.6597-0.05222.1851-0.2760.74910.560.070.4414-0.48211.26020.1470.21310.5548-0.05270.4874-0.591122.1006-24.0278
88.05711.70533.1566.85581.92084.76451.29131.37621.12850.51040.5988-0.4747-1.3682-0.3283-0.30821.36040.3558-0.02111.06440.00090.9701-9.953420.9924-22.7771
92.2646-0.14430.31596.7153-0.14463.9873-0.32920.0417-0.2186-0.66080.46630.06370.2960.70920.11790.83870.17930.09090.65370.03520.45061.0296.5151-17.7478
101.3436-0.7042-0.44872.42830.69052.7842-0.6921-1.005-0.0727-0.05350.87731.7619-0.5617-1.4116-0.2830.91770.1371-0.16891.38640.24781.4327-22.79369.7392-51.3638
110.0110.2685-0.67025.6382-0.47474.690.5581-0.7921-1.1133-0.9916-0.02790.41020.33270.4155-0.5280.9838-0.0724-0.45221.45780.2311.3003-15.87126.5197-59.9045
123.4680.36510.13995.16281.7982.1026-0.49610.2143-0.3822-0.31990.57570.2648-0.0006-0.0574-0.19030.5428-0.0715-0.01850.5532-0.07490.6941-2.4016-5.0352-39.8363
136.71861.31980.22895.24520.99937.4810.20170.1520.41650.0348-0.17270.9750.0999-0.6256-0.13360.56860.12030.12460.68840.0310.7897-8.95421.0535-36.1264
144.4519-2.9004-0.39375.6985-0.55551.9038-0.2595-0.5169-0.0123-1.22690.8289-0.39870.03180.2675-0.39090.7180.0122-0.05130.9389-0.08380.7143-2.5565-6.6252-49.9501
156.6884-0.22845.26996.31850.10486.1798-1.14321.5912-0.0915-1.67460.44331.3179-1.3588-0.14290.94391.2352-0.0904-0.53381.7708-0.10851.6053-34.6525-1.1591-17.6521
164.1614-0.62040.99314.8941-1.50693.28520.09090.3395-0.5266-0.52410.15730.2490.20380.036-0.06370.75050.2958-0.04070.62890.00730.7135-9.9342.7662-10.5527
174.91582.02051.70524.7724-0.49384.3841-0.34710.1442-0.017-0.43430.22480.3925-0.6113-0.19230.23670.71040.13750.05680.6128-0.07590.5714-7.32663.8655-10.1531
184.515-0.08931.15233.88830.72710.8275-1.68650.6959-1.9252-1.04310.79360.6410.4325-2.11460.47181.3349-0.2094-0.3371.635-0.07271.6716-31.4348-7.8157-17.7584
196.62190.48721.35193.226-0.85823.632-0.3540.7494-0.0654-1.48750.69381.265-0.13040.2267-0.22311.0037-0.2645-0.2951.5719-0.04951.2323-12.8465-2.6781-61.6432
208.04031.58320.5145.81542.18292.2777-0.78281.2162-0.1393-0.82371.1655-0.3317-0.86950.9873-0.68670.6577-0.20510.04950.9015-0.04010.68498.69517.5203-50.0697
215.3562-2.14712.93996.40270.40234.8577-0.9841-0.3761-0.028-2.13210.0221-0.2205-0.20980.09390.58720.7868-0.10040.00450.6788-0.04920.75514.53672.8494-50.9189
223.58650.5389-0.6619-0.450.39133.7524-0.6890.9229-0.6974-0.80051.01060.8736-0.0886-0.0845-0.43550.9851-0.3008-0.31571.23920.08941.06-10.8861-2.0805-60.5551
Refinement TLS group
IDRefine-IDRefine TLS-IDSelection detailsAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1chain 'A' and (resid 39 through 62 )A39 - 62
2X-RAY DIFFRACTION2chain 'A' and (resid 63 through 80 )A63 - 80
3X-RAY DIFFRACTION3chain 'A' and (resid 81 through 99 )A81 - 99
4X-RAY DIFFRACTION4chain 'B' and (resid 37 through 62 )B37 - 62
5X-RAY DIFFRACTION5chain 'B' and (resid 63 through 100 )B63 - 100
6X-RAY DIFFRACTION6chain 'C' and (resid 37 through 62 )C37 - 62
7X-RAY DIFFRACTION7chain 'C' and (resid 63 through 74 )C63 - 74
8X-RAY DIFFRACTION8chain 'C' and (resid 75 through 80 )C75 - 80
9X-RAY DIFFRACTION9chain 'C' and (resid 81 through 100 )C81 - 100
10X-RAY DIFFRACTION10chain 'D' and (resid 37 through 80 )D37 - 80
11X-RAY DIFFRACTION11chain 'D' and (resid 81 through 99 )D81 - 99
12X-RAY DIFFRACTION12chain 'E' and (resid 37 through 62 )E37 - 62
13X-RAY DIFFRACTION13chain 'E' and (resid 63 through 80 )E63 - 80
14X-RAY DIFFRACTION14chain 'E' and (resid 81 through 100 )E81 - 100
15X-RAY DIFFRACTION15chain 'F' and (resid 1 through 5 )F1 - 5
16X-RAY DIFFRACTION16chain 'F' and (resid 6 through 16 )F6 - 16
17X-RAY DIFFRACTION17chain 'G' and (resid 1 through 10 )G1 - 10
18X-RAY DIFFRACTION18chain 'G' and (resid 11 through 16 )G11 - 16
19X-RAY DIFFRACTION19chain 'H' and (resid 1 through 10 )H1 - 10
20X-RAY DIFFRACTION20chain 'H' and (resid 11 through 16 )H11 - 16
21X-RAY DIFFRACTION21chain 'I' and (resid 1 through 5 )I1 - 5
22X-RAY DIFFRACTION22chain 'I' and (resid 6 through 16 )I6 - 16

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