Bet v I/Major latex protein / Pathogenesis-related protein Bet v 1 family / START domain / Alpha-D-Glucose-1,6-Bisphosphate; Chain A, domain 4 / START-like domain superfamily / 2-Layer Sandwich / Alpha Beta Similarity search - Domain/homology
S-NORCOCLAURINESYNTHASE / NORCOCLAURINE SYNTHASE FROM THALICTRUM FLAVUM
Mass: 22606.209 Da / Num. of mol.: 2 / Fragment: RESIDUES 16-210 / Mutation: YES Source method: isolated from a genetically manipulated source Details: THE PROTEIN LACKS THE FIRST 15 RESIDUES AND IS HIS-TAGGED AT THE C-TERMINUS. Source: (gene. exp.) THALICTRUM FLAVUM (yellow meadow-rue) / Plasmid: PET22-B / Production host: ESCHERICHIA COLI (E. coli) / Strain (production host): BL21DE3 / References: UniProt: Q67A25, (S)-norcoclaurine synthase
Mass: 18.015 Da / Num. of mol.: 173 / Source method: isolated from a natural source / Formula: H2O
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Details
Compound details
ENGINEERED RESIDUE IN CHAIN A, THR 16 TO MSE ENGINEERED RESIDUE IN CHAIN A, ILE 17 TO THR ...ENGINEERED RESIDUE IN CHAIN A, THR 16 TO MSE ENGINEERED RESIDUE IN CHAIN A, ILE 17 TO THR ENGINEERED RESIDUE IN CHAIN A, ASN 18 TO GLY ENGINEERED RESIDUE IN CHAIN A, CYS 19 TO SER ENGINEERED RESIDUE IN CHAIN B, THR 16 TO MSE ENGINEERED RESIDUE IN CHAIN B, ILE 17 TO THR ENGINEERED RESIDUE IN CHAIN B, ASN 18 TO GLY ENGINEERED RESIDUE IN CHAIN B, CYS 19 TO SER
Sequence details
DATABASE NAME NCBI THE PROTEIN HAS SIX HIS AT THE C- TERMINUS AND LACKS THE FIRST 15 RESIDUES
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Experimental details
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Experiment
Experiment
Method: X-RAY DIFFRACTION / Number of used crystals: 1
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Sample preparation
Crystal
Density Matthews: 3.2 Å3/Da / Density % sol: 61 % / Description: NONE
Crystal grow
pH: 4.5 Details: AMMONIUM SULFATE 1.4-1.8 M, NACL 0.2 M, ACETATE BUFFER PH 4.0-4.5
Resolution: 2.09→50 Å / Cor.coef. Fo:Fc: 0.941 / Cor.coef. Fo:Fc free: 0.921 / SU B: 5.069 / SU ML: 0.136 / Cross valid method: THROUGHOUT / ESU R: 0.19 / ESU R Free: 0.179 / Stereochemistry target values: MAXIMUM LIKELIHOOD / Details: HYDROGENS HAVE BEEN ADDED IN THE RIDING POSITIONS.
Rfactor
Num. reflection
% reflection
Selection details
Rfree
0.26605
1508
5 %
RANDOM
Rwork
0.22086
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obs
0.22312
28573
97.67 %
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Solvent computation
Ion probe radii: 0.8 Å / Shrinkage radii: 0.8 Å / VDW probe radii: 1.2 Å / Solvent model: MASK