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- PDB-2w90: Geobacillus stearothermophilus 6-phosphogluconate dehydrogenase w... -
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Open data
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Basic information
Entry | Database: PDB / ID: 2w90 | ||||||
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Title | Geobacillus stearothermophilus 6-phosphogluconate dehydrogenase with bound 6- phosphogluconate | ||||||
![]() | 6-PHOSPHOGLUCONATE DEHYDROGENASE, DECARBOXYLATING | ||||||
![]() | OXIDOREDUCTASE / 6PDH / GEOBACILLUS / DEHYDROGENASE / PHSOPHOGLUCONATE | ||||||
Function / homology | ![]() 6-Phosphogluconate Dehydrogenase, domain 3 / N-(1-d-carboxylethyl)-l-norvaline Dehydrogenase; domain 2 / N-(1-d-carboxylethyl)-l-norvaline Dehydrogenase; domain 2 / Single alpha-helices involved in coiled-coils or other helix-helix interfaces / NAD(P)-binding Rossmann-like Domain / Up-down Bundle / Rossmann fold / Orthogonal Bundle / 3-Layer(aba) Sandwich / Mainly Alpha / Alpha Beta Similarity search - Domain/homology | ||||||
Biological species | ![]() ![]() | ||||||
Method | ![]() ![]() ![]() | ||||||
![]() | Cameron, S. / Martini, V.P. / Iulek, J. / Hunter, W.N. | ||||||
![]() | ![]() Title: Geobacillus Stearothermophilus 6-Phosphogluconate Dehydrogenase, Complexed with 6-Phosphogluconate. Authors: Cameron, S. / Martini, V.P. / Iulek, J. / Hunter, W.N. | ||||||
History |
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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Downloads & links
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Download
PDBx/mmCIF format | ![]() | 214.5 KB | Display | ![]() |
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PDB format | ![]() | 172.6 KB | Display | ![]() |
PDBx/mmJSON format | ![]() | Tree view | ![]() | |
Others | ![]() |
-Validation report
Summary document | ![]() | 720.9 KB | Display | ![]() |
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Full document | ![]() | 737.8 KB | Display | |
Data in XML | ![]() | 43.9 KB | Display | |
Data in CIF | ![]() | 65.9 KB | Display | |
Arichive directory | ![]() ![]() | HTTPS FTP |
-Related structure data
Related structure data | ![]() 2w8zC ![]() 2zi0S C: citing same article ( S: Starting model for refinement |
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Similar structure data |
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Links
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Assembly
Deposited unit | ![]()
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Unit cell |
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Components
#1: Protein | Mass: 52198.641 Da / Num. of mol.: 2 Source method: isolated from a genetically manipulated source Source: (gene. exp.) ![]() ![]() Description: ATCC/LGC-BIOCHEM / Plasmid: PET15B MODIFIED TO CONTAIN TEV CLEAVAGE SITE / Production host: ![]() ![]() References: phosphogluconate dehydrogenase (NADP+-dependent, decarboxylating) #2: Sugar | ChemComp-6PG / | #3: Chemical | #4: Chemical | #5: Water | ChemComp-HOH / | Sequence details | NOT IN UNIPROT, SEQUENCE OBTAINED BY BLAST WITH UNFINISHED | |
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-Experimental details
-Experiment
Experiment | Method: ![]() |
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Sample preparation
Crystal | Density Matthews: 2.76 Å3/Da / Density % sol: 55.48 % / Description: NONE |
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Crystal grow | pH: 7.4 / Details: 0.2 M LISO4, 2.2 M (NH4)2SO4, pH 7.4 |
-Data collection
Diffraction | Mean temperature: 100 K |
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Diffraction source | Source: ![]() ![]() ![]() |
Detector | Type: ADSC CCD / Detector: CCD / Date: Dec 17, 2007 / Details: TORODIAL FOCUSING MIRROR |
Radiation | Protocol: SINGLE WAVELENGTH / Monochromatic (M) / Laue (L): M / Scattering type: x-ray |
Radiation wavelength | Wavelength: 0.979 Å / Relative weight: 1 |
Reflection | Resolution: 2.2→50 Å / Num. obs: 57708 / % possible obs: 99.4 % / Observed criterion σ(I): 0 / Redundancy: 6.28 % / Rmerge(I) obs: 0.12 / Net I/σ(I): 10.43 |
Reflection shell | Resolution: 2.2→2.25 Å / Redundancy: 6.22 % / Rmerge(I) obs: 0.59 / Mean I/σ(I) obs: 3.63 / % possible all: 99.6 |
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Processing
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Refinement | Method to determine structure: ![]() Starting model: PDB ENTRY 2ZI0 Resolution: 2.2→71.07 Å / Cor.coef. Fo:Fc: 0.96 / Cor.coef. Fo:Fc free: 0.926 / SU B: 13.151 / SU ML: 0.17 / TLS residual ADP flag: LIKELY RESIDUAL / Cross valid method: THROUGHOUT / ESU R: 0.241 / ESU R Free: 0.206 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS
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Solvent computation | Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.4 Å / Solvent model: MASK | ||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||||
Displacement parameters | Biso mean: 32.58 Å2
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Refinement step | Cycle: LAST / Resolution: 2.2→71.07 Å
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Refine LS restraints |
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