Chlorine in PDB 6wn8: 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae

All present enzymatic activity of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae:
2.4.2.9;

The structure of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae, PDB code: 6wn8 was solved by G.Minasov, L.Shuvalova, O.Kiryukhina, I.Dubrovska, K.J.F.Satchell, Centerfor Structural Genomics Of Infectious Diseases (Csgid), with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	29.71 / 2.70
Space group	P 31 2 1
Cell size a, b, c (Å), α, β, γ (°)	203.349, 203.349, 157.775, 90.00, 90.00, 120.00
R / Rfree (%)	18.9 / 21.9

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 20; Page 3, Binding sites: 21 - 23;

Binding sites:

The binding sites of Chlorine atom in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae (pdb code 6wn8). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 23 binding sites of Chlorine where determined in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae, PDB code: 6wn8:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Chlorine binding site 1 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl312 b:95.3 occ:1.00 CG A:LYS67 3.5 84.0 1.0 N A:GLY68 3.7 77.2 1.0 OE1 A:GLU50 4.0 83.6 1.0 OE2 A:GLU50 4.1 77.5 1.0 CD A:LYS67 4.3 89.5 1.0 CD A:GLU50 4.4 77.4 1.0 CA A:GLY68 4.4 78.7 1.0 CA A:LYS67 4.5 72.8 1.0 CB A:LYS67 4.5 77.5 1.0 C A:LYS67 4.6 73.2 1.0

Chlorine binding site 2 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl313 b:88.7 occ:1.00 N A:LYS51 3.5 68.4 1.0 CA A:GLU50 3.9 70.5 1.0 CG A:LYS51 4.1 71.5 1.0 C A:GLU50 4.2 67.9 1.0 CB A:LYS51 4.2 67.8 1.0 NZ A:LYS51 4.4 85.6 1.0 CA A:LYS51 4.5 64.8 1.0 CB A:GLU50 4.5 73.5 1.0 O A:THR49 4.6 60.4 1.0 CD A:LYS51 4.6 78.4 1.0 N A:GLU50 5.0 68.1 1.0

Chlorine binding site 3 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl314 b:90.6 occ:1.00 O B:HOH543 2.9 56.5 1.0 OG A:SER182 3.6 50.1 1.0 NZ A:LYS12 4.1 62.1 1.0 CB A:SER182 4.2 49.5 1.0 CD A:LYS12 4.2 56.7 1.0 CE A:LYS12 4.3 58.5 1.0 NH2 A:ARG19 4.5 54.5 1.0 CD2 A:LEU15 4.9 50.9 1.0

Chlorine binding site 4 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl315 b:93.6 occ:1.00 N A:THR53 3.5 57.4 1.0 OG1 A:THR53 3.7 56.1 1.0 CA A:VAL52 4.1 59.3 1.0 CB A:THR53 4.1 55.8 1.0 C A:VAL52 4.2 57.8 1.0 CA A:THR53 4.4 55.2 1.0 O A:LYS51 4.6 63.0 1.0 CG1 A:VAL52 4.7 60.8 1.0 CB A:VAL52 4.9 59.6 1.0

Chlorine binding site 5 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl310 b:84.4 occ:1.00 OG B:SER182 3.4 43.7 1.0 NZ B:LYS12 3.6 58.5 1.0 CB B:SER182 4.0 42.4 1.0 NH2 B:ARG19 4.3 59.0 1.0 CD B:LYS12 4.4 57.8 1.0 CE B:LYS12 4.5 58.5 1.0 OE2 B:GLU5 4.9 60.1 1.0 CA B:SER182 4.9 42.0 1.0 CD2 B:LEU15 5.0 54.1 1.0 O A:HOH406 5.0 49.7 1.0

Chlorine binding site 6 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl311 b:77.7 occ:1.00 N B:ASN120 3.4 57.2 1.0 OD1 B:ASN120 4.1 65.4 1.0 CA B:ASN120 4.2 56.5 1.0 CA B:SER119 4.3 54.4 1.0 C B:SER119 4.3 55.5 1.0 O B:HOH528 4.4 61.2 1.0 CB B:SER119 4.6 56.7 1.0 CG B:ASN120 5.0 62.4 1.0

Chlorine binding site 7 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 7 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ C:Cl312 b:86.2 occ:1.00 N C:GLU55 3.1 56.2 1.0 CB C:GLU55 3.7 59.9 1.0 OE2 D:GLU20 3.7 72.1 1.0 CA C:GLU55 4.0 58.2 1.0 CA C:ILE54 4.0 57.2 1.0 C C:ILE54 4.0 56.2 1.0 OE1 D:GLU20 4.1 73.2 1.0 CB C:ILE54 4.1 57.1 1.0 CD D:GLU20 4.3 70.2 1.0 O C:GLU55 4.6 56.4 1.0 CG2 C:ILE54 4.7 56.5 1.0 CE1 D:HIS21 4.7 84.9 1.0 C C:GLU55 4.8 57.3 1.0

Chlorine binding site 8 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 8 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ D:Cl312 b:79.8 occ:1.00 N D:ASN120 3.4 58.6 1.0 OD1 D:ASN120 4.1 63.8 1.0 CA D:ASN120 4.2 58.9 1.0 CA D:SER119 4.3 58.0 1.0 C D:SER119 4.3 57.0 1.0 CB D:SER119 4.6 61.5 1.0 CG D:ASN120 4.9 62.1 1.0

Chlorine binding site 9 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 9 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ E:Cl310 b:85.9 occ:1.00 N E:LYS51 3.4 67.3 1.0 CG E:LYS51 3.8 74.4 1.0 CA E:GLU50 3.9 61.8 1.0 CB E:LYS51 4.0 70.5 1.0 C E:GLU50 4.2 59.6 1.0 CD E:LYS51 4.2 78.8 1.0 CA E:LYS51 4.3 67.2 1.0 CB E:GLU50 4.5 65.5 1.0 NZ B:LYS70 4.6 64.0 1.0 CE E:LYS51 4.6 81.3 1.0 O E:THR49 4.7 57.0 1.0 O E:LYS51 5.0 65.8 1.0

Chlorine binding site 10 out of 23 in the 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 10 of 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae within 5.0Å range: probe atom residue distance (Å) B Occ E:Cl311 b:86.0 occ:1.00 O E:HOH432 3.6 57.4 1.0 OXT H:LYS208 5.0 86.5 1.0 CD E:LYS116 5.0 66.6 1.0

G.Minasov, L.Shuvalova, O.Kiryukhina, I.Dubrovska, K.J.F.Satchell, Center For Structural Genomics Of Infectious Diseases(Csgid). 2.70 Angstrom Resolution Crystal Structure of Uracil Phosphoribosyl Transferase From Klebsiella Pneumoniae To Be Published.