Iron in PDB 6nli: 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)

Enzymatic activity of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)

All present enzymatic activity of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11):
1.16.3.1;

Protein crystallography data

The structure of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11), PDB code: 6nli was solved by S.Lovell, A.Punchi-Hewage, K.P.Battaile, H.Yao, B.Nammalwar, K.K.Gnanasekaran, R.A.Bunce, A.B.Reitz, M.Rivera, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 47.22 / 1.90
Space group C 2 2 21
Cell size a, b, c (Å), α, β, γ (°) 129.546, 194.227, 202.759, 90.00, 90.00, 90.00
R / Rfree (%) 16.6 / 20.5

Iron Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 11;

Binding sites:

The binding sites of Iron atom in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) (pdb code 6nli). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 11 binding sites of Iron where determined in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11), PDB code: 6nli:
Jump to Iron binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Iron binding site 1 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 1 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe201

b:20.6
occ:1.00
 OD1 E:ASN148 2.7 19.9 1.0
OD1 J:ASN148 2.8 19.6 1.0
OD1 K:ASN148 2.8 22.0 1.0
OD1 A:ASN148 2.8 22.0 1.0
OE1 E:GLN151 2.9 20.2 1.0
OE1 K:GLN151 2.9 20.9 1.0
OE1 A:GLN151 2.9 22.2 1.0
OE1 J:GLN151 2.9 20.2 1.0
CG E:ASN148 3.6 22.9 1.0
CG J:ASN148 3.6 22.2 1.0
CG K:ASN148 3.6 20.1 1.0
CG A:ASN148 3.7 23.5 1.0
CD E:GLN151 3.9 22.9 1.0
CD K:GLN151 3.9 21.5 1.0
CD J:GLN151 3.9 24.2 1.0
CD A:GLN151 3.9 21.9 1.0
ND2 A:ASN148 4.0 25.1 1.0
ND2 E:ASN148 4.0 21.2 1.0
ND2 K:ASN148 4.0 25.3 1.0
ND2 J:ASN148 4.0 18.6 1.0
NE2 E:GLN151 4.1 21.1 1.0
NE2 J:GLN151 4.1 21.3 1.0
NE2 K:GLN151 4.1 21.2 1.0
NE2 A:GLN151 4.1 23.5 1.0
CB J:ASN148 4.8 21.9 1.0
CB E:ASN148 4.8 20.3 1.0
CB K:ASN148 4.8 16.2 1.0
CB A:ASN148 4.9 22.0 1.0

Iron binding site 2 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 2 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe202

b:24.9
occ:0.50
 FE A:HEM202 0.0 24.9 0.5
FE A:HEM202 0.2 25.5 0.5
NC A:HEM202 1.9 23.3 0.5
ND A:HEM202 1.9 27.4 0.5
NB A:HEM202 2.0 24.1 0.5
NA A:HEM202 2.0 27.4 0.5
NC A:HEM202 2.1 26.5 0.5
ND A:HEM202 2.1 28.9 0.5
NA A:HEM202 2.2 28.7 0.5
NB A:HEM202 2.2 25.7 0.5
SD A:MET52 2.4 25.4 1.0
C4C A:HEM202 2.8 26.1 0.5
C1D A:HEM202 2.9 25.5 0.5
C4D A:HEM202 3.0 25.3 0.5
C1C A:HEM202 3.0 24.9 0.5
C1B A:HEM202 3.0 25.6 0.5
C4A A:HEM202 3.1 25.8 0.5
C4B A:HEM202 3.1 24.9 0.5
C1A A:HEM202 3.1 25.3 0.5
C1C A:HEM202 3.1 24.9 0.5
C4D A:HEM202 3.1 27.7 0.5
C4C A:HEM202 3.1 23.5 0.5
C1D A:HEM202 3.1 23.0 0.5
C1A A:HEM202 3.2 27.7 0.5
CHD A:HEM202 3.2 24.4 0.5
C4B A:HEM202 3.2 26.2 0.5
C4A A:HEM202 3.3 23.1 0.5
C1B A:HEM202 3.3 23.3 0.5
CE A:MET52 3.3 23.2 1.0
CHB A:HEM202 3.4 24.8 0.5
CHA A:HEM202 3.4 27.5 0.5
CHA A:HEM202 3.4 27.5 0.5
CHC A:HEM202 3.4 25.5 0.5
CHC A:HEM202 3.5 24.4 0.5
CHD A:HEM202 3.5 23.6 0.5
CG A:MET52 3.6 26.6 1.0
CHB A:HEM202 3.7 23.7 0.5
C3C A:HEM202 4.1 23.1 0.5
C2D A:HEM202 4.1 26.1 0.5
C2C A:HEM202 4.2 22.8 0.5
C3D A:HEM202 4.2 26.0 0.5
C2B A:HEM202 4.2 23.8 0.5
C3B A:HEM202 4.3 20.9 0.5
C3A A:HEM202 4.3 26.2 0.5
C2A A:HEM202 4.3 26.0 0.5
C2C A:HEM202 4.3 24.6 0.5
C3D A:HEM202 4.3 27.9 0.5
C3C A:HEM202 4.3 25.4 0.5
C2D A:HEM202 4.3 24.3 0.5
CB A:MET52 4.3 24.9 1.0
C2A A:HEM202 4.4 28.1 0.5
C3B A:HEM202 4.4 24.6 0.5
C3A A:HEM202 4.5 24.4 0.5
C2B A:HEM202 4.5 26.5 0.5

Iron binding site 3 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 3 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 3 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Fe202

b:25.5
occ:0.50
 FE A:HEM202 0.0 25.5 0.5
FE A:HEM202 0.2 24.9 0.5
NC A:HEM202 1.9 26.5 0.5
ND A:HEM202 1.9 28.9 0.5
NC A:HEM202 2.0 23.3 0.5
NB A:HEM202 2.0 25.7 0.5
NA A:HEM202 2.1 28.7 0.5
ND A:HEM202 2.1 27.4 0.5
NB A:HEM202 2.2 24.1 0.5
NA A:HEM202 2.2 27.4 0.5
SD A:MET52 2.4 25.4 1.0
C4C A:HEM202 2.9 23.5 0.5
C1D A:HEM202 2.9 23.0 0.5
C1C A:HEM202 3.0 24.9 0.5
C4D A:HEM202 3.0 27.7 0.5
C4C A:HEM202 3.0 26.1 0.5
C1C A:HEM202 3.1 24.9 0.5
C4B A:HEM202 3.1 26.2 0.5
C1B A:HEM202 3.1 23.3 0.5
C1A A:HEM202 3.1 27.7 0.5
C4A A:HEM202 3.1 23.1 0.5
C1D A:HEM202 3.1 25.5 0.5
C4D A:HEM202 3.1 25.3 0.5
C4B A:HEM202 3.2 24.9 0.5
C1A A:HEM202 3.2 25.3 0.5
CHD A:HEM202 3.2 23.6 0.5
C1B A:HEM202 3.2 25.6 0.5
C4A A:HEM202 3.3 25.8 0.5
CHD A:HEM202 3.4 24.4 0.5
CE A:MET52 3.4 23.2 1.0
CHC A:HEM202 3.4 24.4 0.5
CHC A:HEM202 3.4 25.5 0.5
CHA A:HEM202 3.4 27.5 0.5
CHA A:HEM202 3.4 27.5 0.5
CHB A:HEM202 3.4 23.7 0.5
CG A:MET52 3.5 26.6 1.0
CHB A:HEM202 3.6 24.8 0.5
C3C A:HEM202 4.1 25.4 0.5
C2D A:HEM202 4.1 24.3 0.5
C2C A:HEM202 4.1 24.6 0.5
C3D A:HEM202 4.2 27.9 0.5
CB A:MET52 4.2 24.9 1.0
C3C A:HEM202 4.3 23.1 0.5
C2C A:HEM202 4.3 22.8 0.5
C2B A:HEM202 4.3 26.5 0.5
C3B A:HEM202 4.3 24.6 0.5
C2A A:HEM202 4.3 28.1 0.5
C3A A:HEM202 4.3 24.4 0.5
C2D A:HEM202 4.3 26.1 0.5
C3D A:HEM202 4.3 26.0 0.5
C3B A:HEM202 4.4 20.9 0.5
C2A A:HEM202 4.4 26.0 0.5
C2B A:HEM202 4.4 23.8 0.5
C3A A:HEM202 4.5 26.2 0.5

Iron binding site 4 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 4 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 4 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Fe201

b:25.9
occ:1.00
 OD1 L:ASN148 2.7 27.6 1.0
OD1 G:ASN148 2.8 26.9 1.0
OD1 B:ASN148 2.8 30.1 1.0
OE1 C:GLN151 2.9 28.7 1.0
OE1 G:GLN151 2.9 24.5 1.0
OD1 C:ASN148 2.9 26.9 1.0
OE1 L:GLN151 2.9 28.1 1.0
OE1 B:GLN151 3.0 26.2 1.0
CG L:ASN148 3.6 34.6 1.0
CG B:ASN148 3.6 30.1 1.0
CG G:ASN148 3.6 34.5 1.0
CG C:ASN148 3.7 26.0 1.0
CD C:GLN151 3.8 26.3 1.0
CD G:GLN151 3.9 24.3 1.0
CD B:GLN151 3.9 28.4 1.0
ND2 B:ASN148 3.9 29.5 1.0
CD L:GLN151 3.9 28.9 1.0
ND2 C:ASN148 4.0 31.0 1.0
ND2 G:ASN148 4.0 24.8 1.0
ND2 L:ASN148 4.0 31.9 1.0
NE2 G:GLN151 4.1 25.4 1.0
NE2 C:GLN151 4.1 28.6 1.0
NE2 B:GLN151 4.1 27.7 1.0
NE2 L:GLN151 4.2 25.1 1.0
CB L:ASN148 4.8 30.6 1.0
CB B:ASN148 4.9 25.3 1.0
CB G:ASN148 4.9 26.4 1.0
CB C:ASN148 4.9 28.7 1.0

Iron binding site 5 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 5 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 5 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Fe201

b:26.2
occ:1.00
 FE C:HEM201 0.0 26.2 1.0
NC C:HEM201 2.0 27.1 1.0
NA C:HEM201 2.1 27.6 1.0
NB C:HEM201 2.1 23.2 1.0
ND C:HEM201 2.1 26.7 1.0
SD C:MET52 2.3 21.1 1.0
SD I:MET52 2.4 22.1 1.0
C4B C:HEM201 3.0 26.1 1.0
C1A C:HEM201 3.0 27.8 1.0
C1C C:HEM201 3.0 22.7 1.0
C4D C:HEM201 3.0 24.8 1.0
C4C C:HEM201 3.1 27.6 1.0
C1D C:HEM201 3.1 21.2 1.0
C1B C:HEM201 3.1 20.6 1.0
C4A C:HEM201 3.1 22.5 1.0
CE C:MET52 3.3 25.3 1.0
CHC C:HEM201 3.3 29.1 1.0
CHA C:HEM201 3.4 32.7 1.0
CE I:MET52 3.4 23.8 1.0
CG C:MET52 3.5 21.7 1.0
CHD C:HEM201 3.5 25.5 1.0
CG I:MET52 3.5 19.0 1.0
CHB C:HEM201 3.5 24.4 1.0
CB C:MET52 4.2 22.5 1.0
CB I:MET52 4.2 21.4 1.0
C3B C:HEM201 4.3 27.2 1.0
C2A C:HEM201 4.3 24.8 1.0
C3D C:HEM201 4.3 23.5 1.0
C2C C:HEM201 4.3 26.1 1.0
C3C C:HEM201 4.3 26.3 1.0
C2D C:HEM201 4.3 21.0 1.0
C3A C:HEM201 4.3 25.1 1.0
C2B C:HEM201 4.3 26.0 1.0

Iron binding site 6 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 6 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 6 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Fe201

b:21.6
occ:1.00
 OD1 D:ASN148 2.7 23.9 1.0
OD1 F:ASN148 2.8 20.3 1.0
OD1 I:ASN148 2.8 23.3 1.0
OE1 D:GLN151 2.9 22.4 1.0
OE1 F:GLN151 2.9 23.1 1.0
OE1 I:GLN151 3.0 25.6 1.0
CG D:ASN148 3.6 24.8 1.0
CG F:ASN148 3.6 20.0 1.0
CG I:ASN148 3.7 21.5 1.0
CD D:GLN151 3.8 22.8 1.0
CD F:GLN151 3.9 21.3 1.0
CD I:GLN151 3.9 22.6 1.0
ND2 D:ASN148 3.9 27.6 1.0
ND2 F:ASN148 4.0 26.4 1.0
NE2 D:GLN151 4.0 22.7 1.0
ND2 I:ASN148 4.1 22.8 1.0
NE2 F:GLN151 4.1 24.6 1.0
NE2 I:GLN151 4.2 25.1 1.0
CB D:ASN148 4.8 27.5 1.0
CB F:ASN148 4.8 25.5 1.0
CB I:ASN148 4.9 22.2 1.0

Iron binding site 7 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 7 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 7 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Fe202

b:26.3
occ:0.50
 FE D:HEM202 0.0 26.3 0.5
NB D:HEM202 2.0 24.9 0.5
NA D:HEM202 2.0 25.6 0.5
NC D:HEM202 2.1 24.7 0.5
ND D:HEM202 2.1 25.9 0.5
SD D:MET52 2.4 23.1 1.0
C1B D:HEM202 3.1 28.1 0.5
C4B D:HEM202 3.1 27.1 0.5
C1A D:HEM202 3.1 28.1 0.5
C1C D:HEM202 3.1 26.6 0.5
C4D D:HEM202 3.1 28.0 0.5
C4A D:HEM202 3.1 24.5 0.5
C4C D:HEM202 3.1 28.2 0.5
C1D D:HEM202 3.1 24.4 0.5
CE D:MET52 3.3 24.2 1.0
CHC D:HEM202 3.4 26.8 0.5
CHA D:HEM202 3.4 24.7 0.5
CHB D:HEM202 3.4 28.3 0.5
CHD D:HEM202 3.5 28.2 0.5
CG D:MET52 3.5 26.5 1.0
C2B D:HEM202 4.3 27.9 0.5
C3B D:HEM202 4.3 27.6 0.5
C2A D:HEM202 4.3 27.2 0.5
C3A D:HEM202 4.3 26.6 0.5
C3D D:HEM202 4.3 27.0 0.5
C2C D:HEM202 4.3 27.4 0.5
CB D:MET52 4.3 21.4 1.0
C3C D:HEM202 4.3 28.1 0.5
C2D D:HEM202 4.3 26.4 0.5

Iron binding site 8 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 8 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 8 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Fe201

b:25.8
occ:1.00
 FE E:HEM201 0.0 25.8 1.0
NA E:HEM201 2.0 25.2 1.0
ND E:HEM201 2.1 27.3 1.0
NB E:HEM201 2.1 24.2 1.0
NC E:HEM201 2.1 24.4 1.0
SD E:MET52 2.3 23.9 1.0
SD B:MET52 2.4 24.5 1.0
C1A E:HEM201 3.0 27.6 1.0
C4D E:HEM201 3.0 29.8 1.0
C4B E:HEM201 3.1 22.8 1.0
C4A E:HEM201 3.1 27.5 1.0
C1C E:HEM201 3.1 32.6 1.0
C1B E:HEM201 3.1 23.5 1.0
C1D E:HEM201 3.1 33.1 1.0
C4C E:HEM201 3.1 31.3 1.0
CE E:MET52 3.3 27.7 1.0
CE B:MET52 3.4 23.2 1.0
CHA E:HEM201 3.4 25.6 1.0
CHC E:HEM201 3.4 29.7 1.0
CHB E:HEM201 3.5 23.8 1.0
CG E:MET52 3.5 24.7 1.0
CHD E:HEM201 3.5 27.3 1.0
CG B:MET52 3.5 28.8 1.0
CB E:MET52 4.2 24.0 1.0
CB B:MET52 4.2 24.4 1.0
C2A E:HEM201 4.2 24.4 1.0
C3D E:HEM201 4.3 29.7 1.0
C3A E:HEM201 4.3 26.6 1.0
C2D E:HEM201 4.3 28.1 1.0
C3B E:HEM201 4.3 25.6 1.0
C2B E:HEM201 4.3 25.7 1.0
C2C E:HEM201 4.3 25.2 1.0
C3C E:HEM201 4.3 31.7 1.0

Iron binding site 9 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 9 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 9 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
F:Fe201

b:25.4
occ:1.00
 FE F:HEM201 0.0 25.4 1.0
ND F:HEM201 2.0 24.5 1.0
NC F:HEM201 2.0 20.9 1.0
NB F:HEM201 2.0 22.6 1.0
NA F:HEM201 2.1 27.8 1.0
SD F:MET52 2.3 23.3 1.0
SD K:MET52 2.4 22.5 1.0
C1C F:HEM201 3.0 20.7 1.0
C4B F:HEM201 3.0 21.8 1.0
C4D F:HEM201 3.0 23.9 1.0
C4C F:HEM201 3.0 23.3 1.0
C1D F:HEM201 3.0 23.5 1.0
C1A F:HEM201 3.1 21.1 1.0
C1B F:HEM201 3.2 22.9 1.0
C4A F:HEM201 3.2 25.4 1.0
CHC F:HEM201 3.3 24.1 1.0
CE F:MET52 3.3 27.1 1.0
CE K:MET52 3.3 22.7 1.0
CHA F:HEM201 3.4 22.8 1.0
CHD F:HEM201 3.4 24.2 1.0
CG F:MET52 3.5 25.1 1.0
CG K:MET52 3.5 23.4 1.0
CHB F:HEM201 3.6 25.4 1.0
C2C F:HEM201 4.2 26.4 1.0
C3D F:HEM201 4.2 24.1 1.0
CB F:MET52 4.2 20.5 1.0
C2D F:HEM201 4.2 28.1 1.0
C3C F:HEM201 4.2 25.4 1.0
C3B F:HEM201 4.2 25.6 1.0
CB K:MET52 4.3 22.9 1.0
C2A F:HEM201 4.3 25.8 1.0
C2B F:HEM201 4.3 24.9 1.0
C3A F:HEM201 4.4 26.1 1.0

Iron binding site 10 out of 11 in 6nli

Go back to Iron Binding Sites List in 6nli
Iron binding site 10 out of 11 in the 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 10 of 1.90 A Resolution Structure of Wt Bfrb From Pseudomonas Aeruginosa in Complex with A Protein-Protein Interaction Inhibitor (Analog 11) within 5.0Å range:
probe atom residue distance (Å) B Occ
J:Fe201

b:22.4
occ:1.00
 FE J:HEM201 0.0 22.4 1.0
NC J:HEM201 2.0 20.9 1.0
NB J:HEM201 2.0 19.1 1.0
ND J:HEM201 2.1 21.9 1.0
NA J:HEM201 2.1 21.4 1.0
SD J:MET52 2.3 19.5 1.0
SD H:MET52 2.4 20.6 1.0
C1C J:HEM201 3.0 22.3 1.0
C4C J:HEM201 3.0 23.4 1.0
C1D J:HEM201 3.0 22.9 1.0
C4D J:HEM201 3.1 21.0 1.0
C4B J:HEM201 3.1 19.4 1.0
C1B J:HEM201 3.1 21.4 1.0
C1A J:HEM201 3.1 20.3 1.0
C4A J:HEM201 3.1 20.3 1.0
CHC J:HEM201 3.4 21.1 1.0
CHD J:HEM201 3.4 20.8 1.0
CE J:MET52 3.4 19.9 1.0
CHA J:HEM201 3.4 23.8 1.0
CE H:MET52 3.4 23.6 1.0
CHB J:HEM201 3.5 19.7 1.0
CG J:MET52 3.5 21.9 1.0
CG H:MET52 3.5 19.1 1.0
CB J:MET52 4.2 16.5 1.0
CB H:MET52 4.2 17.8 1.0
C3C J:HEM201 4.3 23.1 1.0
C2D J:HEM201 4.3 26.9 1.0
C3D J:HEM201 4.3 23.0 1.0
C2C J:HEM201 4.3 20.7 1.0
C3B J:HEM201 4.3 18.6 1.0
C2A J:HEM201 4.3 22.8 1.0
C2B J:HEM201 4.3 20.1 1.0
C3A J:HEM201 4.3 24.0 1.0

Reference:

A.N.D.Punchi Hewage, H.Yao, B.Nammalwar, K.K.Gnanasekaran, S.Lovell, R.A.Bunce, K.Eshelman, S.M.Phaniraj, M.M.Lee, B.R.Peterson, K.P.Battaile, A.B.Reitz, M.Rivera. Small Molecule Inhibitors of the Bfrb-Bfd Interaction Decrease Pseudomonas Aeruginosa Fitness and Potentiate Fluoroquinolone Activity. J.Am.Chem.Soc. V. 141 8171 2019.
ISSN: ESSN 1520-5126
PubMed: 31038945
DOI: 10.1021/JACS.9B00394
Page generated: Wed Aug 7 03:45:56 2024

Last articles

Zn in 9JYW
Zn in 9IR4
Zn in 9IR3
Zn in 9GMX
Zn in 9GMW
Zn in 9JEJ
Zn in 9ERF
Zn in 9ERE
Zn in 9EGV
Zn in 9EGW
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy