Iron in PDB 5jj5: Crystal Structure of Iron Uptake Abc Transporter Substrate-Binding Protein Piaa From Streptococcus Pneumoniae Canada MDR_19A Bound to Hydroxymate Siderophore Ferrioxamine E and Iron(III)

The structure of Crystal Structure of Iron Uptake Abc Transporter Substrate-Binding Protein Piaa From Streptococcus Pneumoniae Canada MDR_19A Bound to Hydroxymate Siderophore Ferrioxamine E and Iron(III), PDB code: 5jj5 was solved by P.J.Stogios, Z.Wawrzak, M.Kurdritska, V.Yim, A.Savchenko, W.F.Anderson, Center For 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)	29.24 / 2.30
Space group	P 1 21 1
Cell size a, b, c (Å), α, β, γ (°)	77.809, 73.844, 87.161, 90.00, 115.79, 90.00
R / Rfree (%)	14.6 / 19.6

The structure of Crystal Structure of Iron Uptake Abc Transporter Substrate-Binding Protein Piaa From Streptococcus Pneumoniae Canada MDR_19A Bound to Hydroxymate Siderophore Ferrioxamine E and Iron(III) also contains other interesting chemical elements:

Chlorine

(Cl)

1 atom

The binding sites of Iron atom in the Crystal Structure of Iron Uptake Abc Transporter Substrate-Binding Protein Piaa From Streptococcus Pneumoniae Canada MDR_19A Bound to Hydroxymate Siderophore Ferrioxamine E and Iron(III) (pdb code 5jj5). This binding sites where shown within 5.0 Angstroms radius around Iron atom.
In total 2 binding sites of Iron where determined in the Crystal Structure of Iron Uptake Abc Transporter Substrate-Binding Protein Piaa From Streptococcus Pneumoniae Canada MDR_19A Bound to Hydroxymate Siderophore Ferrioxamine E and Iron(III), PDB code: 5jj5:
Jump to Iron binding site number: 1; 2;

Iron binding site 1 out of 2 in the Crystal Structure of Iron Uptake Abc Transporter Substrate-Binding Protein Piaa From Streptococcus Pneumoniae Canada MDR_19A Bound to Hydroxymate Siderophore Ferrioxamine E and Iron(III)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 1 of Crystal Structure of Iron Uptake Abc Transporter Substrate-Binding Protein Piaa From Streptococcus Pneumoniae Canada MDR_19A Bound to Hydroxymate Siderophore Ferrioxamine E and Iron(III) within 5.0Å range: probe atom residue distance (Å) B Occ A:Fe401 b:35.7 occ:1.00 OAI A:6L0402 2.1 25.2 1.0 OAH A:6L0402 2.1 20.4 1.0 OAF A:6L0402 2.1 20.0 1.0 OAG A:6L0402 2.1 21.1 1.0 OAD A:6L0402 2.1 22.6 1.0 OAE A:6L0402 2.2 23.9 1.0 CBM A:6L0402 2.6 24.0 1.0 NBO A:6L0402 2.8 26.6 1.0 CBL A:6L0402 2.8 32.3 1.0 NBN A:6L0402 2.8 19.4 1.0 CBK A:6L0402 3.0 22.8 1.0 NBP A:6L0402 3.1 24.3 1.0 O A:HOH505 3.2 27.1 1.0 CBA A:6L0402 4.0 18.8 1.0 OH A:TYR225 4.0 20.6 1.0 CBC A:6L0402 4.1 27.7 1.0 CAJ A:6L0402 4.1 19.6 1.0 CBB A:6L0402 4.2 17.0 1.0 NH2 A:ARG231 4.2 16.5 1.0 CAZ A:6L0402 4.3 34.7 1.0 CBD A:6L0402 4.3 17.2 1.0 NH1 A:ARG231 4.4 16.9 1.0 OD2 B:ASP89 4.4 62.2 1.0 CAY A:6L0402 4.5 25.0 1.0 CAP A:6L0402 4.6 21.2 1.0 CAR A:6L0402 4.6 30.1 1.0 CAL A:6L0402 4.7 29.3 1.0 CAQ A:6L0402 4.7 21.0 1.0 CZ A:ARG231 4.8 17.5 1.0 CE1 A:TYR225 4.8 24.8 1.0 CAX A:6L0402 4.8 23.2 1.0 CAW A:6L0402 4.8 24.0 1.0 CZ A:TYR225 4.9 22.3 1.0 CE1 A:PHE255 4.9 25.9 1.0 CE A:MET213 4.9 60.2 1.0 CAV A:6L0402 5.0 29.3 1.0

Iron binding site 2 out of 2 in the Crystal Structure of Iron Uptake Abc Transporter Substrate-Binding Protein Piaa From Streptococcus Pneumoniae Canada MDR_19A Bound to Hydroxymate Siderophore Ferrioxamine E and Iron(III)


Mono view


Stereo pair view

A full contact list of Iron with other atoms in the Fe binding site number 2 of Crystal Structure of Iron Uptake Abc Transporter Substrate-Binding Protein Piaa From Streptococcus Pneumoniae Canada MDR_19A Bound to Hydroxymate Siderophore Ferrioxamine E and Iron(III) within 5.0Å range: probe atom residue distance (Å) B Occ B:Fe401 b:41.0 occ:1.00 OAI B:6L0402 2.1 30.4 1.0 OAD B:6L0402 2.1 34.2 1.0 OAE B:6L0402 2.2 28.3 1.0 OAF B:6L0402 2.2 38.2 1.0 OAG B:6L0402 2.2 20.4 1.0 OAH B:6L0402 2.2 24.3 1.0 CBM B:6L0402 2.7 30.9 1.0 CBL B:6L0402 2.9 32.6 1.0 NBP B:6L0402 2.9 25.9 1.0 NBN B:6L0402 3.0 27.8 1.0 NBO B:6L0402 3.0 24.3 1.0 CBK B:6L0402 3.0 37.6 1.0 O B:HOH511 3.4 58.3 1.0 OH B:TYR225 4.0 26.5 1.0 CBA B:6L0402 4.1 30.6 1.0 CBC B:6L0402 4.2 23.3 1.0 CBB B:6L0402 4.2 31.9 1.0 NH1 B:ARG231 4.2 19.5 1.0 NH2 B:ARG231 4.2 19.9 1.0 CBD B:6L0402 4.3 23.4 1.0 CAZ B:6L0402 4.4 34.5 1.0 CAY B:6L0402 4.4 45.5 1.0 CAJ B:6L0402 4.5 30.1 1.0 CAQ B:6L0402 4.6 17.9 1.0 CAV B:6L0402 4.6 54.4 1.0 CAR B:6L0402 4.6 22.4 1.0 CAP B:6L0402 4.7 37.3 1.0 CAL B:6L0402 4.7 22.5 1.0 CZ B:ARG231 4.7 24.3 1.0 CE1 B:TYR225 4.8 22.8 1.0 CE B:MET213 4.9 28.4 0.5 CE1 B:PHE255 4.9 21.6 1.0 CZ B:TYR225 4.9 28.1 1.0 CAW B:6L0402 4.9 39.4 1.0 O B:HOH625 5.0 47.4 1.0

P.J.Stogios, P.J.Stogios, Z.Wawrzak, M.Kurdritska, V.Yim, A.Savchenko, W.F.Anderson, Center For Structural Genomics Of Infectious Diseases (Csgid). N/A N/A.