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- PDB-1f2n: RICE YELLOW MOTTLE VIRUS -

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Basic information

Entry
Database: PDB / ID: 1f2n
TitleRICE YELLOW MOTTLE VIRUS
ComponentsCAPSID PROTEIN
KeywordsVIRUS / PLANT VIRUS / CAPSID PROTEIN / COAT PROTEIN / BETA-ANNULUS / DOMAIN SWAPPING / Icosahedral virus
Function / homology
Function and homology information


T=3 icosahedral viral capsid / structural molecule activity / metal ion binding
Similarity search - Function
Plant viruses icosahedral capsid proteins 'S' region signature. / Icosahedral viral capsid protein, S domain / Viral coat protein (S domain) / Jelly Rolls - #20 / Viral coat protein subunit / Jelly Rolls / Sandwich / Mainly Beta
Similarity search - Domain/homology
Biological speciesRice yellow mottle virus
MethodX-RAY DIFFRACTION / SYNCHROTRON / Resolution: 2.8 Å
AuthorsQu, C. / Liljas, L. / Opalka, N. / Brugidou, C. / Yeager, M. / Beachy, R.N. / Fauquet, C.M. / Johnson, J.E. / Lin, T.
Citation
Journal: Structure Fold.Des. / Year: 2000
Title: 3D domain swapping modulates the stability of members of an icosahedral virus group.
Authors: Qu, C. / Liljas, L. / Opalka, N. / Brugidou, C. / Yeager, M. / Beachy, R.N. / Fauquet, C.M. / Johnson, J.E. / Lin, T.
#1: Journal: J.GEN.VIROL. / Year: 1994
Title: NUCLEOTIDE SEQUENCE AND GENOME CHARACTERIZATION OF RICE YELLOW MOTTLE VIRUS RNA
Authors: YASSI, M.N. / RITZENTHALER, C. / BRUGIDOU, C. / FAUQUET, C. / BEACHY, R.N.
History
DepositionMay 26, 2000Deposition site: RCSB / Processing site: RCSB
Revision 1.0Nov 1, 2000Provider: repository / Type: Initial release
Revision 1.1Apr 27, 2008Group: Version format compliance
Revision 1.2Jul 13, 2011Group: Version format compliance
Revision 1.3Feb 7, 2024Group: Data collection / Database references / Derived calculations
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_struct_conn_angle / pdbx_struct_oper_list / struct_conn / struct_site
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_seq_id / _pdbx_struct_conn_angle.ptnr2_label_asym_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 / _pdbx_struct_oper_list.name / _pdbx_struct_oper_list.symmetry_operation / _pdbx_struct_oper_list.type / _struct_conn.pdbx_dist_value / _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_site.pdbx_auth_asym_id / _struct_site.pdbx_auth_comp_id / _struct_site.pdbx_auth_seq_id

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

Downloads & links

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Assembly

Deposited unit
A: CAPSID PROTEIN
B: CAPSID PROTEIN
C: CAPSID PROTEIN
hetero molecules


Theoretical massNumber of molelcules
Total (without water)78,1496
Polymers78,0293
Non-polymers1203
Water3,585199
1
A: CAPSID PROTEIN
B: CAPSID PROTEIN
C: CAPSID PROTEIN
hetero molecules
x 60


Theoretical massNumber of molelcules
Total (without water)4,688,947360
Polymers4,681,733180
Non-polymers7,214180
Water3,243180
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
point symmetry operation59
2


  • Idetical with deposited unit
  • icosahedral asymmetric unit
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
3
A: CAPSID PROTEIN
B: CAPSID PROTEIN
C: CAPSID PROTEIN
hetero molecules
x 5


  • icosahedral pentamer
  • 391 kDa, 15 polymers
Theoretical massNumber of molelcules
Total (without water)390,74630
Polymers390,14415
Non-polymers60115
Water27015
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
point symmetry operation4
4
A: CAPSID PROTEIN
B: CAPSID PROTEIN
C: CAPSID PROTEIN
hetero molecules
x 6


  • icosahedral 23 hexamer
  • 469 kDa, 18 polymers
Theoretical massNumber of molelcules
Total (without water)468,89536
Polymers468,17318
Non-polymers72118
Water32418
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
point symmetry operation5
5


  • Idetical with deposited unit in distinct coordinate
  • icosahedral asymmetric unit, std point frame
TypeNameSymmetry operationNumber
transform to point frame1
6
A: CAPSID PROTEIN
B: CAPSID PROTEIN
C: CAPSID PROTEIN
hetero molecules
x 60


  • crystal asymmetric unit, crystal frame
  • 4.69 MDa, 180 polymers
Theoretical massNumber of molelcules
Total (without water)4,688,947360
Polymers4,681,733180
Non-polymers7,214180
Water3,243180
TypeNameSymmetry operationNumber
identity operation1_555x,y,z2
point symmetry operation59
Unit cell
Length a, b, c (Å)283.500, 401.800, 284.000
Angle α, β, γ (deg.)90.00, 89.40, 90.00
Int Tables number4
Space group name H-MP1211
SymmetryPoint symmetry: (Hermann–Mauguin notation: 532 / Schoenflies symbol: I (icosahedral))
Noncrystallographic symmetry (NCS)NCS oper:
IDCodeMatrixVector
1given(1), (1), (1)
2generate(0.54724468, -0.80458246, 0.23058694), (0.7232674, 0.31595588, -0.61404898), (0.42119774, 0.50281105, 0.75483343)15.93512, -7.66651, -12.60505
3generate(-0.18532883, -0.57857436, 0.79429524), (0.36568878, -0.79085076, -0.49074107), (0.9120992, 0.19951639, 0.35814559)27.91731, 9.17669, -19.26273
4generate(-0.18532883, 0.36568878, 0.9120992), (-0.57857436, -0.79085076, 0.19951639), (0.79429524, -0.49074107, 0.35814559)19.38759, 27.25286, -10.77235
5generate(0.54724468, 0.7232674, 0.42119774), (-0.80458246, 0.31595588, 0.50281105), (0.23058694, -0.61404898, 0.75483343)2.13374, 21.58136, 1.13267
6generate(-0.98859032, -0.01176587, 0.15016908), (-0.01176587, -0.98786682, -0.15485709), (0.15016908, -0.15485709, 0.97645713)132.69091, 12.04486, -9.13799
7generate(-0.48625979, 0.8671916, -0.10737855), (-0.78615613, -0.38051957, 0.48699425), (0.38145768, 0.32122203, 0.86677935)115.13491, 21.38284, -17.8661
8generate(0.31588073, 0.61123925, -0.7256762), (-0.50031628, 0.75716612, 0.41997986), (0.80616561, 0.23040407, 0.54498713)102.09148, 5.63401, -25.17597
9generate(0.3093003, -0.42590547, -0.85025752), (0.45073272, 0.8529473, -0.26328865), (0.83736094, -0.30180363, 0.45578639)111.5862, -13.43727, -20.96561
10generate(-0.49690714, -0.81094381, -0.30895538), (0.75267348, -0.22554237, -0.61855742), (0.43193278, -0.53990812, 0.72244951)130.49768, -9.47515, -11.05359
11generate(0.97865435, -0.12847852, -0.16040242), (-0.12847852, -0.9916576, 0.01041529), (-0.16040242, 0.01041529, -0.98699675)13.1823, 8.4749, 155.82288
12generate(0.37507792, -0.90865377, 0.18347991), (-0.7831559, -0.20471156, 0.58716268), (-0.49596713, -0.36392513, -0.78840035)31.78414, 13.89884, 165.62814
13generate(-0.37465893, -0.49661989, 0.78294276), (-0.3293275, 0.86066556, 0.38832743), (-0.86670299, -0.11235425, -0.48600663)42.41448, -4.41264, 170.4527
14generate(-0.23444536, 0.5382063, 0.80954886), (0.60583125, 0.7321588, -0.31130691), (-0.76026565, 0.41746554, -0.49771343)30.38255, -21.1537, 163.62918
15generate(0.60194824, 0.76573018, 0.22652947), (0.72996275, -0.41263987, -0.54486945), (-0.32374789, 0.49334128, -0.80734236)12.31607, -13.18876, 154.58746
16generate(-0.99006403, 0.14024439, 0.01023334), (0.14024439, 0.97952441, 0.14444179), (0.01023334, 0.14444179, -0.98946038)142.95908, -20.61259, 143.68355
17generate(-0.43606281, 0.84604463, -0.30668829), (0.84604463, 0.26927525, -0.46010795), (-0.30668829, -0.46010795, -0.83321244)125.97811, -27.708, 155.21145
18generate(0.24410703, 0.463955, -0.85156181), (0.463955, -0.82698093, -0.31756621), (-0.85156181, -0.31756621, -0.4171261)116.40901, -10.49089, 164.35444
19generate(0.11047389, -0.47798961, -0.87139053), (-0.47798961, -0.79425534, 0.37507916), (-0.87139053, 0.37507916, -0.31621855)127.47595, 7.24528, 158.47722
20generate(-0.65228577, -0.67805377, -0.33877183), (-0.67805377, 0.32222636, 0.66061582), (-0.33877183, 0.66061582, -0.66994059)143.88479, 0.98973, 145.7019
21generate(-0.0003042, -0.98893291, -0.14836309), (-0.14806215, 0.14677239, -0.97802631), (0.98897801, 0.02166944, -0.14646819)82.97708, 81.66847, 11.81285
22generate(-0.7779196, -0.38681301, 0.49519368), (-0.38681301, -0.32626063, -0.86251359), (0.49519368, -0.86251359, 0.10418023)92.42401, 90.51192, 29.25245
23generate(-0.49690714, 0.75267348, 0.43193278), (-0.81094381, -0.22554237, -0.53990812), (-0.30895538, -0.61855742, 0.72244951)76.75133, 97.72132, 42.44269
24generate(0.45438351, 0.85479496, -0.25072137), (-0.8343202, 0.30973796, -0.45603969), (-0.3121625, 0.41639882, 0.85391252)57.61815, 93.33352, 33.15511
25generate(0.76130101, -0.22157698, -0.60936394), (-0.42463681, 0.53984113, -0.72681162), (0.49000445, 0.81208078, 0.31689185)61.46587, 83.41232, 14.22483
26generate(-0.01034316, 0.99991266, 0.00822739), (-0.0022234, 0.00820481, -0.99996387), (-0.99994404, -0.01036108, 0.00213834)72.38089, 72.72702, 144.64067
27generate(0.72100935, 0.32838703, -0.61017004), (-0.41646499, -0.49841162, -0.760357), (-0.55380721, 0.80233897, -0.22259773)64.44653, 85.23328, 128.75892
28generate(0.37507792, -0.7831559, -0.49596713), (-0.90865377, -0.20471156, -0.36392513), (0.18347991, 0.58716268, -0.78840035)81.10954, 92.00227, 116.58865
29generate(-0.57007196, -0.79860158, 0.19301158), (-0.79860158, 0.48342148, -0.35852362), (0.19301158, -0.35852362, -0.91334952)99.34222, 83.67948, 124.94876
30generate(-0.80827529, 0.30339539, 0.50462093), (-0.2383968, 0.61501104, -0.75161718), (-0.53838464, -0.72781361, -0.42476974)93.94761, 71.76672, 142.28587
31generate(0.15055672, 0.97917667, 0.13618265), (-0.00688098, -0.13671158, 0.990587), (0.98857742, -0.1500766, -0.01384515)51.4736, -71.43832, 2.21041
32generate(0.84795776, 0.25671547, -0.4637508), (0.31458839, 0.46041958, 0.83008912), (0.42661667, -0.84977113, 0.30965665)44.64928, -82.98626, 19.28859
33generate(0.45438351, -0.8343202, -0.3121625), (0.85479496, 0.30973796, 0.41639882), (-0.25072137, -0.45603969, 0.85391252)62.03909, -91.96638, 28.69832
34generate(-0.48625979, -0.78615613, 0.38145768), (0.8671916, -0.38051957, 0.32122203), (-0.10737855, 0.48699425, 0.86677935)79.61089, -85.96846, 17.43567
35generate(-0.67403507, 0.33464658, 0.65855022), (0.33464658, -0.65644055, 0.67608984), (0.65855022, 0.67608984, 0.33047562)73.08106, -73.28141, 1.06524
36generate(-0.13990937, -0.99015642, 0.00395304), (0.15716654, -0.01826562, 0.98740318), (-0.9776114, 0.13876824, 0.15817499)82.00072, -83.05001, 131.70451
37generate(-0.7910475, -0.19828949, 0.57872716), (0.48868961, 0.36425266, 0.79278147), (-0.36800314, 0.90994575, -0.19123915)87.31246, -92.85177, 113.06848
38generate(-0.33255429, 0.86480262, 0.37619684), (0.86480262, 0.12051597, 0.48743443), (0.37619684, 0.48743443, -0.78796168)68.93232, -97.85003, 102.63878
39generate(0.60194824, 0.72996275, -0.32374789), (0.76573018, -0.41263987, 0.49334128), (0.22652947, -0.54486945, -0.80734236)52.26103, -91.13737, 114.82889
40generate(0.72100935, -0.41646499, -0.55380721), (0.32838703, -0.49841162, 0.80233897), (-0.61017004, -0.760357, -0.22259773)60.33775, -81.99045, 132.7925
41generate(-0.0003042, -0.14806215, 0.98897801), (-0.98893291, 0.14677239, 0.02166944), (-0.14836309, -0.97802631, -0.14646819)0.4346, 69.81611, 93.91486
42generate(0.3093003, 0.45073272, 0.83736094), (-0.42590547, 0.8529473, -0.30180363), (-0.85025752, -0.26328865, 0.45578639)-10.90124, 52.65896, 100.89496
43generate(0.84795776, 0.31458839, 0.42661667), (0.25671547, 0.46041958, -0.84977113), (-0.4637508, 0.83008912, 0.30965665)-19.98303, 43.13723, 83.6193
44generate(0.87126187, -0.3683483, 0.32437983), (0.11557097, -0.48835081, -0.8649606), (0.47701792, 0.79109609, -0.38291107)-14.26003, 54.40962, 65.96225
45generate(0.34700715, -0.65428207, 0.67193825), (-0.65428207, -0.68219543, -0.32638071), (0.67193825, -0.32638071, -0.66481172)-1.64125, 70.89807, 72.32526
46generate(0.15055672, -0.00688098, 0.98857742), (0.97917667, -0.13671158, -0.1500766), (0.13618265, 0.990587, -0.01384515)-10.42642, -59.83646, 63.78666
47generate(0.49380115, 0.37375827, 0.78515297), (0.37375827, -0.90648337, 0.19645012), (0.78515297, 0.19645012, -0.58731777)-20.43559, -41.29334, 58.53693
48generate(0.87126187, 0.11557097, 0.47701792), (-0.3683483, -0.48835081, 0.79109609), (0.32437983, -0.8649606, -0.38291107)-25.32912, -30.86416, 76.94552
49generate(0.76130101, -0.42463681, 0.49000445), (-0.22157698, 0.53984113, 0.81208078), (-0.60936394, -0.72681162, 0.31689185)-18.34432, -42.96169, 93.57239
50generate(0.31588073, -0.50031628, 0.80616561), (0.61123925, 0.75716613, 0.23040407), (-0.7256762, 0.41997986, 0.54498714)-9.13394, -60.86756, 85.43977
51generate(-0.13990937, 0.15716654, -0.9776114), (-0.99015642, -0.01826562, 0.13876824), (0.00395304, 0.98740318, 0.15817499)153.28118, 61.40017, 60.84733
52generate(-0.37465893, -0.3293275, -0.86670299), (-0.49661989, 0.86066556, -0.11235425), (0.78294276, 0.38832743, -0.48600663)162.16963, 44.01276, 51.34658
53generate(-0.80827529, -0.2383968, -0.53838464), (0.30339539, 0.61501104, -0.72781361), (0.50462093, -0.75161718, -0.42476974)169.64901, 30.917, 66.97189
54generate(-0.84151538, 0.3042955, -0.44638114), (0.3042955, -0.41574298, -0.85706594), (-0.44638114, -0.85706594, 0.25725836)165.38308, 40.21078, 86.12961
55generate(-0.42844252, 0.54876709, -0.7178382), (-0.49516349, -0.80712949, -0.3214889), (-0.75581091, 0.21770776, 0.61753802)155.2672, 59.05042, 82.34442
56generate(-0.01034316, -0.0022234, -0.99994404), (0.99991266, 0.00820481, -0.01036108), (0.00822739, -0.99996387, 0.00213834)145.54293, -71.47265, 71.81959
57generate(-0.42844252, -0.49516349, -0.75581091), (0.54876709, -0.80712949, 0.21770776), (-0.7178382, -0.3214889, 0.61753802)157.9995, -55.47122, 79.58997
58generate(-0.91094434, -0.19176256, -0.36524996), (-0.19176256, -0.58707982, 0.78648866), (-0.36524996, 0.78648866, 0.49802416)164.49542, -43.2829, 62.83173
59generate(-0.7910475, 0.48868961, -0.36800314), (-0.19828949, 0.36425266, 0.90994575), (0.57872716, 0.79278147, -0.19123915)156.05355, -51.75154, 44.70419
60generate(-0.23444536, 0.60583125, -0.76026565), (0.5382063, 0.7321588, 0.41746554), (0.80954886, -0.31130691, -0.49771343)144.34027, -69.17376, 50.25899

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Components

#1: Protein CAPSID PROTEIN


Mass: 26009.625 Da / Num. of mol.: 3 / Source method: isolated from a natural source
Details: COLLECTED FROM RICE FIELD IN THE IVORY COAST AND WAS PROPAGATED UNDER CONTAINED CONDITIONS IN A SUSCEPTIBLE RICE VARIETY IR8 (ORYZA SATIVA L.)
Source: (natural) Rice yellow mottle virus / Genus: Sobemovirus / References: UniProt: Q86527
#2: Chemical ChemComp-CA / CALCIUM ION


Mass: 40.078 Da / Num. of mol.: 3 / Source method: obtained synthetically / Formula: Ca
#3: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 199 / Source method: isolated from a natural source / Formula: H2O

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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

Crystal growTemperature: 293 K / Method: vapor diffusion, hanging drop / pH: 3
Details: 3.6% (w/v) PEG 8000, 200 mM lithium sulfate, 50 mM sodium citrate, pH 3.0, VAPOR DIFFUSION, HANGING DROP, temperature 293.0K
Crystal grow
*PLUS
pH: 4 / Method: vapor diffusion
Components of the solutions
*PLUS
IDConc.Common nameCrystal-IDSol-ID
136 mg/mlprotein1drop
250 mMsodium acetate1drop
3200 mMlithium sulfate1drop
450 mMsodium acetate1reservoir
5200 mMlithium sulfate1reservoir
63.6 %(w/v)PEG80001reservoir

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Data collection

DiffractionMean temperature: 98 K
Diffraction sourceSource: SYNCHROTRON / Site: CHESS / Beamline: F1 / Wavelength: 0.918
DetectorType: FUJI / Detector: IMAGE PLATE / Date: Jan 23, 1997
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.918 Å / Relative weight: 1
ReflectionResolution: 2.8→50 Å / Num. all: 739272 / Num. obs: 739272 / % possible obs: 48.7 % / Observed criterion σ(I): -3 / Redundancy: 1.9 % / Biso Wilson estimate: 48.6 Å2 / Rmerge(I) obs: 0.072 / Net I/σ(I): 10.5
Reflection shellResolution: 2.8→2.83 Å / Redundancy: 1 % / Rmerge(I) obs: 0.257 / Num. unique all: 1399 / % possible all: 2.8
Reflection
*PLUS

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Processing

Software
NameVersionClassification
GLRFphasing
X-PLOR3.851refinement
DENZOdata reduction
SCALEPACKdata scaling
RefinementResolution: 2.8→30 Å / σ(F): 4 / Stereochemistry target values: Engh & Huber / Details: 60-fold non crystallographic symmetry constraints
RfactorNum. reflection% reflectionSelection details
Rfree0.219 56852 -RANDOM
Rwork0.218 ---
all0.246 738802 --
obs0.227 567810 37.2 %-
Refinement stepCycle: LAST / Resolution: 2.8→30 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms4528 0 3 199 4730
Refine LS restraints
Refine-IDTypeDev ideal
X-RAY DIFFRACTIONx_bond_d0.008
X-RAY DIFFRACTIONx_angle_deg1.4
X-RAY DIFFRACTIONx_torsion_deg28
X-RAY DIFFRACTIONx_torsion_impr_deg0.73
Software
*PLUS
Name: X-PLOR / Version: 3.851 / Classification: refinement
Refinement
*PLUS
Highest resolution: 2.8 Å / Lowest resolution: 30 Å / σ(F): 4
Solvent computation
*PLUS
Displacement parameters
*PLUS

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