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- PDB-9i8a: NXT1-NXF1 complex crystallized in space group P65 2 2 -

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Basic information

Entry
Database: PDB / ID: 9i8a
TitleNXT1-NXF1 complex crystallized in space group P65 2 2
Components
  • NTF2-related export protein 1
  • Nuclear RNA export factor 1
KeywordsTRANSPORT PROTEIN / Cancer Nuclear Transport Factor 2 Like Export Factor 1
Function / homology
Function and homology information


nuclear RNA export factor complex / nuclear pore central transport channel / nuclear inclusion body / Transport of the SLBP independent Mature mRNA / Transport of the SLBP Dependant Mature mRNA / Transport of Mature mRNA Derived from an Intronless Transcript / Transport of Mature mRNA derived from an Intron-Containing Transcript / poly(A)+ mRNA export from nucleus / nuclear pore / mRNA export from nucleus ...nuclear RNA export factor complex / nuclear pore central transport channel / nuclear inclusion body / Transport of the SLBP independent Mature mRNA / Transport of the SLBP Dependant Mature mRNA / Transport of Mature mRNA Derived from an Intronless Transcript / Transport of Mature mRNA derived from an Intron-Containing Transcript / poly(A)+ mRNA export from nucleus / nuclear pore / mRNA export from nucleus / protein export from nucleus / small GTPase binding / cytoplasmic stress granule / protein transport / nuclear speck / mRNA binding / RNA binding / nucleoplasm / nucleus / cytosol / cytoplasm
Similarity search - Function
Nuclear RNA export factor Tap, RNA-binding domain / Tap, RNA-binding / Nuclear transport factor 2/Mtr2 / TAP C-terminal (TAP-C) domain / TAP C-terminal domain / NXF1/2/3/5 leucine-rich repeat domain / TAP C-terminal (TAP-C) domain profile. / C-terminal domain of vertebrate Tap protein / Nuclear RNA export factor / Nuclear RNA export factor, NTF2 domain ...Nuclear RNA export factor Tap, RNA-binding domain / Tap, RNA-binding / Nuclear transport factor 2/Mtr2 / TAP C-terminal (TAP-C) domain / TAP C-terminal domain / NXF1/2/3/5 leucine-rich repeat domain / TAP C-terminal (TAP-C) domain profile. / C-terminal domain of vertebrate Tap protein / Nuclear RNA export factor / Nuclear RNA export factor, NTF2 domain / Nuclear transport factor 2, eukaryote / Nuclear transport factor 2 domain profile. / Nuclear transport factor 2 (NTF2) domain / Nuclear transport factor 2 domain / UBA-like superfamily / NTF2-like domain superfamily / Leucine-rich repeat profile. / Leucine-rich repeat / RNA-binding domain superfamily / Leucine-rich repeat domain superfamily / Nucleotide-binding alpha-beta plait domain superfamily
Similarity search - Domain/homology
Nuclear RNA export factor 1 / NTF2-related export protein 1
Similarity search - Component
Biological speciesHomo sapiens (human)
MethodX-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 1.501 Å
AuthorsKoekemoer, L. / Fairhead, M. / Wright, N.D. / Bowesman-Jones, H.J. / Adams, C.J. / Von Delft, F.
Funding support United Kingdom, United States, 2items
OrganizationGrant numberCountry
Cancer Research UKCGCATF-2023/100049 United Kingdom
National Institutes of Health/National Cancer Institute (NIH/NCI)1OT2CA297644-01 United States
CitationJournal: To Be Published
Title: NXT1-NXF1 complex crystallized in space group P65 2 2
Authors: Koekemoer, L. / Fairhead, M. / Wright, N.D. / Bowesman-Jones, H.J. / Adams, C.J. / Von Delft, F.
History
DepositionFeb 4, 2025Deposition site: PDBE / Processing site: PDBE
Revision 1.0May 14, 2025Provider: repository / Type: Initial release

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Structure visualization

Structure viewerMolecule:
MolmilJmol/JSmol

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Assembly

Deposited unit
B: Nuclear RNA export factor 1
A: NTF2-related export protein 1


Theoretical massNumber of molelcules
Total (without water)36,8212
Polymers36,8212
Non-polymers00
Water3,513195
1


  • Idetical with deposited unit
  • defined by author&software
  • Evidence: gel filtration
TypeNameSymmetry operationNumber
identity operation1_555x,y,z1
Unit cell
Length a, b, c (Å)105.332, 105.332, 171.409
Angle α, β, γ (deg.)90, 90, 120
Int Tables number179
Space group name H-MP6522

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Components

#1: Protein Nuclear RNA export factor 1 / Tip-associated protein / Tip-associating protein / mRNA export factor TAP


Mass: 21163.080 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: NXF1, TAP / Production host: Escherichia coli (E. coli) / References: UniProt: Q9UBU9
#2: Protein NTF2-related export protein 1 / Protein p15


Mass: 15657.482 Da / Num. of mol.: 1
Source method: isolated from a genetically manipulated source
Source: (gene. exp.) Homo sapiens (human) / Gene: NXT1 / Production host: Escherichia coli (E. coli) / References: UniProt: Q9UKK6
#3: Water ChemComp-HOH / water


Mass: 18.015 Da / Num. of mol.: 195 / Source method: isolated from a natural source / Formula: H2O
Has protein modificationN

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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: 298 K / Method: vapor diffusion, sitting drop / Details: 3 M Sodium acetate

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Data collection

DiffractionMean temperature: 100 K / Serial crystal experiment: N
Diffraction sourceSource: SYNCHROTRON / Site: Diamond / Beamline: I04-1 / Wavelength: 0.922 Å
DetectorType: DECTRIS EIGER X 9M / Detector: PIXEL / Date: Jan 23, 2025
RadiationProtocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray
Radiation wavelengthWavelength: 0.922 Å / Relative weight: 1
ReflectionResolution: 1.5→91.22 Å / Num. obs: 89974 / % possible obs: 100 % / Redundancy: 37.5 % / Rmerge(I) obs: 0.113 / Net I/σ(I): 16.6
Reflection shellResolution: 1.5→1.53 Å / Rmerge(I) obs: 5.265 / Num. unique obs: 4422

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Processing

Software
NameVersionClassification
REFMAC5.8.0430 (refmacat 0.4.100)refinement
xia2data reduction
xia2data scaling
SIMBADphasing
RefinementMethod to determine structure: MOLECULAR REPLACEMENT / Resolution: 1.501→91.22 Å / Cor.coef. Fo:Fc: 0.974 / Cor.coef. Fo:Fc free: 0.97 / WRfactor Rfree: 0.167 / WRfactor Rwork: 0.157 / SU B: 7.506 / SU ML: 0.101 / Average fsc free: 0.9586 / Average fsc work: 0.9709 / Cross valid method: FREE R-VALUE / ESU R: 0.054 / ESU R Free: 0.054
Details: Hydrogens have been added in their riding positions
RfactorNum. reflection% reflection
Rfree0.2005 2020 2.247 %
Rwork0.1703 87859 -
all0.171 --
obs-89879 99.951 %
Solvent computationIon probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK BULK SOLVENT
Displacement parametersBiso mean: 38.7 Å2
Baniso -1Baniso -2Baniso -3
1-0.107 Å20.054 Å20 Å2
2--0.107 Å2-0 Å2
3----0.347 Å2
Refinement stepCycle: LAST / Resolution: 1.501→91.22 Å
ProteinNucleic acidLigandSolventTotal
Num. atoms2543 0 0 195 2738
Refine LS restraints
Refine-IDTypeDev idealDev ideal targetNumber
X-RAY DIFFRACTIONr_bond_refined_d0.0110.0122618
X-RAY DIFFRACTIONr_bond_other_d0.0010.0162438
X-RAY DIFFRACTIONr_angle_refined_deg1.6441.8063556
X-RAY DIFFRACTIONr_angle_other_deg0.6151.755606
X-RAY DIFFRACTIONr_dihedral_angle_1_deg6.4265325
X-RAY DIFFRACTIONr_dihedral_angle_2_deg6.115517
X-RAY DIFFRACTIONr_dihedral_angle_3_deg11.84910432
X-RAY DIFFRACTIONr_dihedral_angle_6_deg14.74510123
X-RAY DIFFRACTIONr_chiral_restr0.0930.2401
X-RAY DIFFRACTIONr_gen_planes_refined0.0070.023118
X-RAY DIFFRACTIONr_gen_planes_other0.0010.02640
X-RAY DIFFRACTIONr_nbd_refined0.2090.2437
X-RAY DIFFRACTIONr_symmetry_nbd_other0.1970.21952
X-RAY DIFFRACTIONr_nbtor_refined0.1780.21238
X-RAY DIFFRACTIONr_symmetry_nbtor_other0.0790.21340
X-RAY DIFFRACTIONr_xyhbond_nbd_refined0.1660.2127
X-RAY DIFFRACTIONr_symmetry_nbd_refined0.3520.29
X-RAY DIFFRACTIONr_nbd_other0.1520.269
X-RAY DIFFRACTIONr_symmetry_xyhbond_nbd_refined0.1970.28
X-RAY DIFFRACTIONr_mcbond_it11.6143.561297
X-RAY DIFFRACTIONr_mcbond_other11.5893.5591297
X-RAY DIFFRACTIONr_mcangle_it15.746.3991620
X-RAY DIFFRACTIONr_mcangle_other15.7426.4021621
X-RAY DIFFRACTIONr_scbond_it14.2734.0121321
X-RAY DIFFRACTIONr_scbond_other14.2524.0111321
X-RAY DIFFRACTIONr_scangle_it19.9197.1831935
X-RAY DIFFRACTIONr_scangle_other19.9147.1851936
X-RAY DIFFRACTIONr_lrange_it23.74434.92797
X-RAY DIFFRACTIONr_lrange_other23.2633.9412757
X-RAY DIFFRACTIONr_rigid_bond_restr5.08135056
LS refinement shell

Refine-ID: X-RAY DIFFRACTION / Total num. of bins used: 20

Resolution (Å)Rfactor RfreeNum. reflection RfreeRfactor RworkNum. reflection RworkRfactor allNum. reflection allFsc freeFsc work% reflection obs (%)WRfactor Rwork
1.501-1.540.3941620.34563440.34765320.890.9199.6020.394
1.54-1.5820.3831450.31662190.31863640.9030.9231000.369
1.582-1.6280.2891370.28160680.28162050.930.9471000.348
1.628-1.6780.2761340.2659330.26160670.9580.9561000.312
1.678-1.7330.2651260.2257260.22158520.9520.9711000.27
1.733-1.7930.2221120.19755480.19756600.970.9771000.239
1.793-1.8610.2531240.16653610.16854850.9620.9841000.2
1.861-1.9370.1971220.14551820.14653040.9820.9881000.169
1.937-2.0230.1871260.13449450.13550720.980.99199.98030.153
2.023-2.1220.1751140.13147560.13248700.9870.9921000.143
2.122-2.2370.175990.12945350.1346340.9850.9921000.138
2.237-2.3720.206920.12842960.1343880.9760.9921000.131
2.372-2.5360.22870.14440760.14541630.9710.9891000.138
2.536-2.7390.266940.16237700.16438640.9620.9861000.151
2.739-30.2910.17635070.17735980.9730.9821000.163
3-3.3540.198700.16831940.16932640.9710.9861000.158
3.354-3.8710.118700.13528410.13529110.9930.9911000.13
3.871-4.7390.122530.11424430.11424960.9890.9931000.113
4.739-6.6930.175390.1819420.1819810.9910.9891000.177
6.693-91.220.184230.25211730.25111960.9810.9531000.235

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