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Krypton in PDB 7r2s: Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas

Protein crystallography data

The structure of Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas, PDB code: 7r2s was solved by P.T.Borges, M.Teixeira, C.V.Romao, C.Frazao, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 52.34 / 2.19
Space group I 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 88.952, 64.425, 147.08, 90, 91.46, 90
R / Rfree (%) 25.4 / 29.5

Other elements in 7r2s:

The structure of Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas also contains other interesting chemical elements:

Iron (Fe) 4 atoms

Krypton Binding Sites:

The binding sites of Krypton atom in the Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas (pdb code 7r2s). This binding sites where shown within 5.0 Angstroms radius around Krypton atom.
In total 6 binding sites of Krypton where determined in the Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas, PDB code: 7r2s:
Jump to Krypton binding site number: 1; 2; 3; 4; 5; 6;

Krypton binding site 1 out of 6 in 7r2s

Go back to Krypton Binding Sites List in 7r2s
Krypton binding site 1 out of 6 in the Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas


Mono view


Stereo pair view

A full contact list of Krypton with other atoms in the Kr binding site number 1 of Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Kr505

b:38.7
occ:0.45
CG2 A:ILE213 4.0 22.4 1.0
CZ A:PHE168 4.0 23.5 1.0
CD1 A:ILE213 4.0 28.1 1.0
CG2 A:ILE210 4.1 26.2 1.0
CB A:ILE213 4.2 25.3 1.0
CG1 A:ILE210 4.3 18.4 1.0
CE2 A:PHE168 4.3 16.8 1.0
CG1 A:VAL239 4.3 24.6 1.0
CA A:ILE210 4.4 25.4 1.0
CG2 A:VAL239 4.4 22.3 1.0
CB A:ILE210 4.5 23.3 1.0
O A:ILE210 4.7 33.2 1.0
CD2 A:LEU162 4.7 18.8 1.0
CG1 A:ILE213 4.7 21.9 1.0
CD1 A:ILE210 4.9 25.3 1.0

Krypton binding site 2 out of 6 in 7r2s

Go back to Krypton Binding Sites List in 7r2s
Krypton binding site 2 out of 6 in the Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas


Mono view


Stereo pair view

A full contact list of Krypton with other atoms in the Kr binding site number 2 of Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Kr506

b:58.0
occ:0.60
CD2 A:LEU146 3.9 48.9 1.0
CZ A:PHE168 3.9 23.5 1.0
CG1 A:ILE210 4.2 18.4 1.0
CB A:ALA167 4.2 31.9 1.0
CE1 A:PHE168 4.4 24.1 1.0
CG1 A:VAL206 4.4 14.7 1.0
CD2 A:TYR242 4.4 22.2 1.0
CE2 A:PHE168 4.5 16.8 1.0
CD1 A:ILE210 4.5 25.3 1.0
CE2 A:TYR242 4.7 14.8 1.0
O A:VAL206 4.8 32.1 1.0
CG A:LEU146 4.8 43.7 1.0
CG A:LYS209 4.9 18.1 1.0
CA A:VAL206 4.9 30.6 1.0
CG2 A:VAL206 5.0 21.9 1.0

Krypton binding site 3 out of 6 in 7r2s

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Krypton binding site 3 out of 6 in the Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas


Mono view


Stereo pair view

A full contact list of Krypton with other atoms in the Kr binding site number 3 of Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Kr507

b:34.8
occ:0.50
O A:LEU146 3.3 18.3 1.0
CD2 A:LEU199 3.4 26.9 1.0
N A:ALA167 3.4 16.5 1.0
C A:LEU146 3.6 22.8 1.0
CA A:ALA167 3.6 25.1 1.0
O A:HOH671 3.6 28.2 1.0
CB A:ASP166 3.7 11.4 1.0
N A:HIS147 3.7 17.8 1.0
C A:ASP166 3.8 26.4 1.0
CD1 A:LEU199 3.9 18.1 1.0
CB A:ALA167 3.9 31.9 1.0
CG A:LEU199 4.2 25.5 1.0
CD2 A:HIS147 4.3 27.9 1.0
O A:ASP166 4.3 29.5 1.0
CA A:ASP166 4.4 23.7 1.0
O A:HOH643 4.4 26.8 1.0
CA A:LEU146 4.5 21.4 1.0
CB A:HIS147 4.5 16.5 1.0
CB A:LEU146 4.6 25.4 1.0
CA A:HIS147 4.6 19.5 1.0
CG A:HIS147 4.8 22.9 1.0
OH A:TYR194 4.9 41.0 1.0

Krypton binding site 4 out of 6 in 7r2s

Go back to Krypton Binding Sites List in 7r2s
Krypton binding site 4 out of 6 in the Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas


Mono view


Stereo pair view

A full contact list of Krypton with other atoms in the Kr binding site number 4 of Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Kr505

b:32.9
occ:0.50
O B:LEU146 3.3 23.0 1.0
CD2 B:LEU199 3.4 20.9 1.0
C B:LEU146 3.5 23.6 1.0
N B:ALA167 3.6 14.6 1.0
CA B:ALA167 3.7 29.7 1.0
N B:HIS147 3.7 25.0 1.0
CB B:ASP166 3.9 14.1 1.0
CD1 B:LEU199 3.9 25.7 1.0
C B:ASP166 3.9 21.2 1.0
CB B:ALA167 4.0 23.0 1.0
O B:HOH715 4.0 32.2 1.0
CG B:LEU199 4.3 25.9 1.0
CA B:LEU146 4.4 28.3 1.0
O B:ASP166 4.4 25.2 1.0
CD2 B:HIS147 4.4 29.8 1.0
CB B:LEU146 4.5 33.6 1.0
CA B:ASP166 4.5 26.0 1.0
O B:HOH622 4.5 23.5 1.0
CB B:HIS147 4.6 23.4 1.0
CA B:HIS147 4.6 30.0 1.0
CG B:HIS147 4.9 26.5 1.0

Krypton binding site 5 out of 6 in 7r2s

Go back to Krypton Binding Sites List in 7r2s
Krypton binding site 5 out of 6 in the Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas


Mono view


Stereo pair view

A full contact list of Krypton with other atoms in the Kr binding site number 5 of Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Kr506

b:54.5
occ:0.59
CZ B:PHE168 3.9 28.1 1.0
CG1 B:ILE210 4.1 34.3 1.0
CB B:ALA167 4.2 23.0 1.0
CD1 B:LEU146 4.3 43.3 1.0
CG1 B:VAL206 4.4 27.9 1.0
CD1 B:ILE210 4.4 33.7 1.0
CE2 B:PHE168 4.4 21.5 1.0
CE1 B:PHE168 4.4 19.1 1.0
CD2 B:TYR242 4.5 19.8 1.0
O B:VAL206 4.7 33.9 1.0
CE2 B:TYR242 4.8 14.2 1.0
O B:HOH715 4.8 32.2 1.0
CA B:VAL206 4.9 31.6 1.0
CG2 B:VAL206 4.9 20.3 1.0
CB B:VAL206 5.0 26.7 1.0
CG B:LYS209 5.0 30.4 1.0

Krypton binding site 6 out of 6 in 7r2s

Go back to Krypton Binding Sites List in 7r2s
Krypton binding site 6 out of 6 in the Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas


Mono view


Stereo pair view

A full contact list of Krypton with other atoms in the Kr binding site number 6 of Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Kr507

b:36.0
occ:0.37
CG2 B:ILE213 3.9 34.3 1.0
CD1 B:ILE213 3.9 34.1 1.0
CZ B:PHE168 4.0 28.1 1.0
CE2 B:PHE168 4.1 21.5 1.0
CD2 B:LEU162 4.1 29.9 1.0
CB B:ILE213 4.3 32.7 1.0
CG2 B:VAL239 4.4 27.0 1.0
CG2 B:ILE210 4.5 31.7 1.0
CG1 B:ILE210 4.7 34.3 1.0
CG1 B:VAL239 4.7 25.8 1.0
CG1 B:ILE213 4.7 31.9 1.0
CE B:MET153 4.8 24.5 1.0
CA B:ILE210 4.9 34.9 1.0
CB B:ILE210 5.0 33.8 1.0

Reference:

P.T.Borges, M.Teixeira, C.V.Romao, C.Frazao. Crystal Structure of A Flavodiiron Protein D52K Mutant From Escherichia Coli Pressurized with Krypton Gas To Be Published.
Page generated: Tue Aug 13 01:40:32 2024

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