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- PDB-3umn: Crystal Structure of Lamin-B1 -

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Basic information

Entry
Database: PDB / ID: 3umn
TitleCrystal Structure of Lamin-B1
ComponentsLamin-B1
KeywordsSTRUCTURAL PROTEIN / Structural Genomics Consortium / SGC / Ig-like domain / INTERMEDIATE FILAMENT / LIPOPROTEIN / MEMBRANE / NUCLEUS
Function / homology
Function and homology information


structural constituent of nuclear lamina / Breakdown of the nuclear lamina / Depolymerization of the Nuclear Lamina / Nuclear Envelope Breakdown / nuclear envelope organization / nuclear pore localization / lamin filament / protein localization to nuclear envelope / nuclear lamina / Initiation of Nuclear Envelope (NE) Reformation ...structural constituent of nuclear lamina / Breakdown of the nuclear lamina / Depolymerization of the Nuclear Lamina / Nuclear Envelope Breakdown / nuclear envelope organization / nuclear pore localization / lamin filament / protein localization to nuclear envelope / nuclear lamina / Initiation of Nuclear Envelope (NE) Reformation / RHOF GTPase cycle / RHOD GTPase cycle / nuclear migration / nuclear inner membrane / Formation of Senescence-Associated Heterochromatin Foci (SAHF) / Deregulated CDK5 triggers multiple neurodegenerative pathways in Alzheimer's disease models / phospholipase binding / heterochromatin formation / Meiotic synapsis / Gene and protein expression by JAK-STAT signaling after Interleukin-12 stimulation / structural constituent of cytoskeleton / nuclear matrix / sequence-specific double-stranded DNA binding / nuclear envelope / nuclear membrane / nucleoplasm / membrane / nucleus
Similarity search - Function
Lamin Tail domain / Lamin tail domain superfamily / Lamin tail domain / Lamin Tail Domain / Lamin-tail (LTD) domain profile. / Intermediate filament protein, conserved site / Intermediate filament protein / Intermediate filament (IF) rod domain signature. / Intermediate filament, rod domain / Intermediate filament (IF) rod domain profile. ...Lamin Tail domain / Lamin tail domain superfamily / Lamin tail domain / Lamin Tail Domain / Lamin-tail (LTD) domain profile. / Intermediate filament protein, conserved site / Intermediate filament protein / Intermediate filament (IF) rod domain signature. / Intermediate filament, rod domain / Intermediate filament (IF) rod domain profile. / Intermediate filament protein / Immunoglobulin-like / Sandwich / Mainly Beta
Similarity search - Domain/homology
Biological speciesHomo sapiens (human)
MethodX-RAY DIFFRACTION / MOLECULAR REPLACEMENT / Resolution: 2 Å
AuthorsXu, C. / Bian, C.B. / Amaya, M.F. / Bountra, C. / Weigelt, J. / Arrowsmith, C.H. / Edwards, A.M. / Bochkarev, A. / Min, J. / Structural Genomics Consortium (SGC)
CitationJournal: Febs Lett. / Year: 2012
Title: Crystal structures of the coil 2B fragment and the globular tail domain of human lamin B1.
Authors: Ruan, J. / Xu, C. / Bian, C. / Lam, R. / Wang, J.P. / Kania, J. / Min, J. / Zang, J.
History
DepositionNov 14, 2011Deposition site: RCSB / Processing site: RCSB
SupersessionNov 30, 2011ID: 3HN9
Revision 1.0Nov 30, 2011Provider: repository / Type: Initial release
Revision 1.1Mar 7, 2012Group: Database references
Revision 1.2Feb 28, 2024Group: Data collection / Database references / Derived calculations
Category: chem_comp_atom / chem_comp_bond ...chem_comp_atom / chem_comp_bond / database_2 / pdbx_struct_special_symmetry
Item: _database_2.pdbx_DOI / _database_2.pdbx_database_accession

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Assembly

Deposited unit
A: Lamin-B1
B: Lamin-B1
C: Lamin-B1


Theoretical massNumber of molelcules
Total (without water)40,2813
Polymers40,2813
Non-polymers00
Water1,874104
1
A: Lamin-B1


Theoretical massNumber of molelcules
Total (without water)13,4271
Polymers13,4271
Non-polymers00
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
2
B: Lamin-B1


Theoretical massNumber of molelcules
Total (without water)13,4271
Polymers13,4271
Non-polymers00
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
3
C: Lamin-B1


Theoretical massNumber of molelcules
Total (without water)13,4271
Polymers13,4271
Non-polymers00
Water181
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
MethodPISA
Unit cell
Length a, b, c (Å)107.538, 169.963, 53.613
Angle α, β, γ (deg.)90.00, 90.00, 90.00
Int Tables number21
Space group name H-MC222
Components on special symmetry positions
IDModelComponents
11A-1-

HOH

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Components

#1: Protein Lamin-B1


Mass: 13426.978 Da / Num. of mol.: 3 / Fragment: Globular Tail Domain, UNP residues 428-550
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: LMNB1, LMN2, LMNB / Production host: Escherichia coli (E. coli) / References: UniProt: P20700
#2: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 104 / 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

CrystalDensity Matthews: 3.04 Å3/Da / Density % sol: 59.55 %
Crystal growTemperature: 300 K / Method: vapor diffusion, sitting drop / pH: 7.5
Details: 20% PEG 3350, pH 7.5, VAPOR DIFFUSION, SITTING DROP, temperature 300.0K

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Data collection

DiffractionMean temperature: 100 K
Diffraction sourceSource: ROTATING ANODE / Type: RIGAKU FR-E DW / Wavelength: 1.54178 Å
DetectorType: RIGAKU RAXIS VII / Detector: IMAGE PLATE / Date: May 28, 2009
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 1.54178 Å / Relative weight: 1
ReflectionResolution: 2→100 Å / Num. all: 33777 / Num. obs: 33473 / % possible obs: 99.1 % / Observed criterion σ(F): 0 / Observed criterion σ(I): 0

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Processing

Software
NameVersionClassification
HKL-2000data collection
PHASERphasing
REFMAC5.6.0117refinement
HKL-2000data reduction
HKL-2000data scaling
RefinementMethod to determine structure: MOLECULAR REPLACEMENT / Resolution: 2→25.06 Å / Cor.coef. Fo:Fc: 0.942 / Cor.coef. Fo:Fc free: 0.928 / SU B: 9.533 / SU ML: 0.13 / Cross valid method: THROUGHOUT / ESU R Free: 0.16 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN USED IF PRESENT IN THE INPUT
RfactorNum. reflection% reflectionSelection details
Rfree0.26397 1698 5.1 %RANDOM
Rwork0.24264 ---
obs0.24374 31763 99.34 %-
Solvent computationIon probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK
Displacement parametersBiso mean: 66.645 Å2
Baniso -1Baniso -2Baniso -3
1--0.06 Å2-0 Å20 Å2
2---0 Å20 Å2
3---0.07 Å2
Refinement stepCycle: LAST / Resolution: 2→25.06 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms2711 0 0 104 2815
Refine LS restraints
Refine-IDTypeDev idealDev ideal targetNumber
X-RAY DIFFRACTIONr_bond_refined_d0.0340.022759
X-RAY DIFFRACTIONr_bond_other_d
X-RAY DIFFRACTIONr_angle_refined_deg1.4241.9263738
X-RAY DIFFRACTIONr_angle_other_deg
X-RAY DIFFRACTIONr_dihedral_angle_1_deg5.7035349
X-RAY DIFFRACTIONr_dihedral_angle_2_deg35.69825.385117
X-RAY DIFFRACTIONr_dihedral_angle_3_deg17.33315484
X-RAY DIFFRACTIONr_dihedral_angle_4_deg18.9561512
X-RAY DIFFRACTIONr_chiral_restr0.1510.2423
X-RAY DIFFRACTIONr_gen_planes_refined0.0060.0212044
X-RAY DIFFRACTIONr_gen_planes_other
X-RAY DIFFRACTIONr_nbd_refined
X-RAY DIFFRACTIONr_nbd_other
X-RAY DIFFRACTIONr_nbtor_refined
X-RAY DIFFRACTIONr_nbtor_other
X-RAY DIFFRACTIONr_xyhbond_nbd_refined
X-RAY DIFFRACTIONr_xyhbond_nbd_other
X-RAY DIFFRACTIONr_metal_ion_refined
X-RAY DIFFRACTIONr_metal_ion_other
X-RAY DIFFRACTIONr_symmetry_vdw_refined
X-RAY DIFFRACTIONr_symmetry_vdw_other
X-RAY DIFFRACTIONr_symmetry_hbond_refined
X-RAY DIFFRACTIONr_symmetry_hbond_other
X-RAY DIFFRACTIONr_symmetry_metal_ion_refined
X-RAY DIFFRACTIONr_symmetry_metal_ion_other
X-RAY DIFFRACTIONr_mcbond_it
X-RAY DIFFRACTIONr_mcbond_other
X-RAY DIFFRACTIONr_mcangle_it
X-RAY DIFFRACTIONr_scbond_it
X-RAY DIFFRACTIONr_scangle_it
X-RAY DIFFRACTIONr_rigid_bond_restr
X-RAY DIFFRACTIONr_sphericity_free
X-RAY DIFFRACTIONr_sphericity_bonded
LS refinement shellResolution: 2→2.052 Å / Total num. of bins used: 20
RfactorNum. reflection% reflection
Rfree0.337 114 -
Rwork0.388 2001 -
obs--92.6 %
Refinement TLS params.

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

IDL112)L122)L132)L222)L232)L332)S11 (Å °)S12 (Å °)S13 (Å °)S21 (Å °)S22 (Å °)S23 (Å °)S31 (Å °)S32 (Å °)S33 (Å °)T112)T122)T132)T222)T232)T332)Origin x (Å)Origin y (Å)Origin z (Å)
10.8428-0.16560.03780.23310.15740.14180.00210.04180.0452-0.0103-0.06860.09060.0165-0.02980.06650.1425-0.0139-0.0170.1476-0.01210.11865.634440.245730.0713
20.18750.31710.21740.81720.48780.3038-0.0186-0.00090.03130.02840.0401-0.06190.00990.0199-0.02150.1352-0.0121-0.00980.1404-0.00030.115316.307142.40235.9552
30.27160.0921-0.19720.24760.21470.53640.03540.0325-0.02190.0543-0.0137-0.01060.0622-0.0321-0.02170.1773-0.0194-0.0060.11930.00240.084912.018532.754138.1691
42.05930.17280.39350.01580.03840.2436-0.0101-0.04560.2678-0.0046-0.00240.01090.0545-0.05420.01250.136-0.00080.00210.13-0.00340.154613.145747.94733.4441
510.1157-1.8599-2.21821.30162.03153.24210.1065-0.26650.3285-0.1328-0.25040.0764-0.2122-0.36090.14390.0960.0072-0.04810.2182-0.02930.16-1.231149.312534.7096
61.4087-2.0587-2.558616.909518.819421.00820.17780.0098-0.0425-0.1657-0.0237-0.1702-0.2216-0.0543-0.15410.16870.00020.04240.08-0.01950.093319.129121.051450.8885
70.36570.31940.22470.28930.26030.81150.0278-0.0279-0.0082-0.0028-0.0308-0.0114-0.03570.01820.00290.1543-0.00260.00820.1168-0.01830.125618.810417.493862.1511
80.85580.18040.78140.60621.21522.65960.1591-0.1066-0.0542-0.10340.0029-0.0718-0.1083-0.0797-0.1620.149-0.02490.00330.13130.01080.11345.946716.148458.7251
90.0283-0.0477-0.00210.65470.0320.00740.0445-0.0362-0.02620.1451-0.0665-0.07470.03390.00340.02190.2226-0.044-0.02030.16440.02070.123915.09413.605668.4757
101.61890.48731.292.52560.39731.032-0.0167-0.02050.00610.23150.02130.1012-0.0083-0.0375-0.00460.1668-0.01950.01030.12640.01170.059111.40646.282366.1772
111.202-0.5679-1.54290.26930.72981.98240.05610.02540.0279-0.0319-0.0157-0.0217-0.0781-0.0465-0.04040.1728-0.0065-0.00940.1267-0.00090.103110.729413.870551.8388
124.7871-1.57550.68556.7074-0.76524.0662-0.00260.05140.53170.1554-0.0547-0.1638-0.2561-0.2240.05730.13990.00570.01660.0824-0.02420.08697.792728.271861.8874
131.12011.22210.88221.64051.88183.48030.08320.1048-0.0150.11210.0849-0.09130.1721-0.0862-0.16810.16070.00420.00910.1222-0.02240.121916.097116.419347.3223
140.80680.7194-0.37640.642-0.33530.1776-0.0295-0.049-0.1512-0.0294-0.05-0.13820.00410.01560.07950.1289-0.00310.02970.124-0.01330.1529.348820.249154.517
151.20510.3986-1.15453.4888-0.50241.11210.01050.0582-0.2681-0.0002-0.269-0.0226-0.0173-0.03590.25850.0821-0.01210.05530.13140.0080.178337.365825.647946.8368
162.4684-0.36330.4590.0706-0.06930.08560.0046-0.1306-0.3437-0.00810.0215-0.0296-0.004-0.0213-0.02620.01840.01730.06460.05210.14540.42740.45316.303152.5684
170.8877-0.2627-0.75680.18370.18410.66020.1338-0.0914-0.029-0.0038-0.1518-0.0136-0.14680.13810.0180.0465-0.0796-0.03930.24990.04510.178741.759325.988158.5453
180.8674-0.4067-1.00672.28971.95142.2215-0.0040.1054-0.16270.0531-0.0995-0.05170.0079-0.13880.10340.151-0.03990.04030.1508-0.030.126829.663626.621647.3987
Refinement TLS group
IDRefine-IDRefine TLS-IDAuth asym-IDAuth seq-ID
1X-RAY DIFFRACTION1A431 - 461
2X-RAY DIFFRACTION2A462 - 486
3X-RAY DIFFRACTION3A487 - 523
4X-RAY DIFFRACTION4A524 - 540
5X-RAY DIFFRACTION5A541 - 548
6X-RAY DIFFRACTION6B432 - 440
7X-RAY DIFFRACTION7B441 - 466
8X-RAY DIFFRACTION8B467 - 484
9X-RAY DIFFRACTION9B485 - 503
10X-RAY DIFFRACTION10B504 - 520
11X-RAY DIFFRACTION11B521 - 532
12X-RAY DIFFRACTION12B533 - 539
13X-RAY DIFFRACTION13B540 - 547
14X-RAY DIFFRACTION14C431 - 463
15X-RAY DIFFRACTION15C464 - 480
16X-RAY DIFFRACTION16C481 - 501
17X-RAY DIFFRACTION17C502 - 526
18X-RAY DIFFRACTION18C527 - 548

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