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Yorodumi- PDB-5xhf: Crystal structure of Trastuzumab Fab fragment bearing p-azido-L-p... -
+Open data
-Basic information
Entry | Database: PDB / ID: 5xhf | ||||||
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Title | Crystal structure of Trastuzumab Fab fragment bearing p-azido-L-phenylalanine | ||||||
Components |
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Keywords | IMMUNE SYSTEM / FAB | ||||||
Function / homology | Immunoglobulins / Immunoglobulin-like / Sandwich / Mainly Beta Function and homology information | ||||||
Biological species | MUS MUSCULUS (house mouse) | ||||||
Method | X-RAY DIFFRACTION / SYNCHROTRON / MOLECULAR REPLACEMENT / Resolution: 3.205 Å | ||||||
Authors | Kuratani, M. / Yanagisawa, T. / Sakamoto, K. / Yokoyama, S. | ||||||
Citation | Journal: Bioconjug. Chem. / Year: 2017 Title: Extensive Survey of Antibody Invariant Positions for Efficient Chemical Conjugation Using Expanded Genetic Codes. Authors: Kato, A. / Kuratani, M. / Yanagisawa, T. / Ohtake, K. / Hayashi, A. / Amano, Y. / Kimura, K. / Yokoyama, S. / Sakamoto, K. / Shiraishi, Y. | ||||||
History |
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-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Downloads & links
-Download
PDBx/mmCIF format | 5xhf.cif.gz | 172.9 KB | Display | PDBx/mmCIF format |
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PDB format | pdb5xhf.ent.gz | 137.3 KB | Display | PDB format |
PDBx/mmJSON format | 5xhf.json.gz | Tree view | PDBx/mmJSON format | |
Others | Other downloads |
-Validation report
Arichive directory | https://data.pdbj.org/pub/pdb/validation_reports/xh/5xhf ftp://data.pdbj.org/pub/pdb/validation_reports/xh/5xhf | HTTPS FTP |
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-Related structure data
Related structure data | 5xhgC 1n8zS C: citing same article (ref.) S: Starting model for refinement |
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Similar structure data |
-Links
-Assembly
Deposited unit |
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1 |
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2 |
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Unit cell |
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-Components
#1: Antibody | Mass: 23527.096 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) MUS MUSCULUS (house mouse) / Description: humanized mouse Production host: Escherichia coli str. K-12 substr. W3110 (bacteria) #2: Antibody | Mass: 23425.180 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) MUS MUSCULUS (house mouse) / Description: humanized mouse Production host: Escherichia coli str. K-12 substr. W3110 (bacteria) |
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-Experimental details
-Experiment
Experiment | Method: X-RAY DIFFRACTION / Number of used crystals: 1 |
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-Sample preparation
Crystal | Density Matthews: 2.51 Å3/Da / Density % sol: 51.01 % / Description: THE FILE CONTAINS FRIEDEL PAIRS. |
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Crystal grow | Temperature: 293 K / Method: vapor diffusion, sitting drop / pH: 6.5 / Details: PEG 20000, MES-Na |
-Data collection
Diffraction | Mean temperature: 99 K |
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Diffraction source | Source: SYNCHROTRON / Site: NSRRC / Beamline: TPS 05A / Wavelength: 1 Å |
Detector | Type: RAYONIX MX300-HS / Detector: CCD / Date: Mar 13, 2017 |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 1 Å / Relative weight: 1 |
Reflection | Resolution: 3.2→50 Å / Num. obs: 14758 / % possible obs: 95.7 % / Redundancy: 1.3 % / Net I/σ(I): 2.45 |
-Processing
Software |
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Refinement | Method to determine structure: MOLECULAR REPLACEMENT Starting model: 1N8Z Resolution: 3.205→42.443 Å / SU ML: 0.47 / Cross valid method: FREE R-VALUE / σ(F): 1.98 / Phase error: 32.76 / Details: THE FILE CONTAINS FRIEDEL PAIRS.
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Solvent computation | Shrinkage radii: 0.9 Å / VDW probe radii: 1.11 Å | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Refinement step | Cycle: LAST / Resolution: 3.205→42.443 Å
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Refine LS restraints |
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LS refinement shell |
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