Zinc in PDB 6iu9: Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions

The structure of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions, PDB code: 6iu9 was solved by T.Kato, T.Nishizawa, K.Yamashita, K.Kumazaki, R.Ishitani, O.Nureki, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	42.66 / 3.00
Space group	P 31
Cell size a, b, c (Å), α, β, γ (°)	85.321, 85.321, 97.573, 90.00, 90.00, 120.00
R / Rfree (%)	19.2 / 26.5

The structure of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions also contains other interesting chemical elements:

Iron

(Fe)

7 atoms

Pages:

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

Binding sites:

The binding sites of Zinc atom in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions (pdb code 6iu9). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 20 binding sites of Zinc where determined in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions, PDB code: 6iu9:
Jump to Zinc binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Zinc binding site 1 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn201 b:87.1 occ:1.00 OE2 A:GLU102 1.7 0.2 1.0 O A:HOH301 1.7 43.5 1.0 OE2 A:GLU105 1.8 84.3 1.0 NE2 D:HIS89 1.9 66.1 1.0 CE1 D:HIS89 2.7 76.5 1.0 CD A:GLU102 2.8 0.6 1.0 CD A:GLU105 2.9 98.6 1.0 CD2 D:HIS89 2.9 73.8 1.0 OE1 A:GLU102 3.3 0.9 1.0 ZN A:ZN203 3.3 73.6 1.0 OE1 A:GLU105 3.4 99.6 1.0 FE A:FE2202 3.6 84.6 1.0 OE1 A:GLU153 3.6 74.1 1.0 O D:GLY87 3.8 61.1 1.0 ND1 D:HIS89 3.8 89.8 1.0 CG D:HIS89 4.0 75.1 1.0 OE2 A:GLU153 4.0 81.9 1.0 CG A:GLU102 4.0 100.0 1.0 CA A:GLU102 4.1 0.6 1.0 CD A:GLU153 4.2 75.4 1.0 CG A:GLU105 4.2 0.8 1.0 CB A:GLU102 4.2 99.8 1.0 OE1 A:GLU113 4.3 52.6 1.0 OE2 A:GLU113 4.5 66.8 1.0 OE1 A:GLU116 4.6 56.6 1.0 N D:GLY87 4.6 70.2 1.0 CD A:GLU113 4.7 66.9 1.0 CB A:GLU105 4.7 0.7 1.0 C D:GLY87 4.7 72.2 1.0 CD1 A:LEU154 4.8 92.6 1.0 N A:GLU102 4.9 0.5 1.0 CD2 A:LEU154 4.9 92.0 1.0

Zinc binding site 2 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn203 b:73.6 occ:1.00 O D:GLY87 1.9 61.1 1.0 O A:HOH301 2.0 43.5 1.0 OE2 A:GLU116 2.1 62.2 1.0 OE1 A:GLU113 2.2 52.6 1.0 N D:GLY87 2.2 70.2 1.0 CD A:GLU116 2.7 64.6 1.0 OE1 A:GLU116 2.7 56.6 1.0 C D:GLY87 2.7 72.2 1.0 CA D:GLY87 2.9 69.6 1.0 CD A:GLU113 3.1 66.9 1.0 OE2 A:GLU105 3.1 84.3 1.0 OE1 A:GLU105 3.1 99.6 1.0 ZN A:ZN201 3.3 87.1 1.0 CD A:GLU105 3.4 98.6 1.0 OE2 A:GLU113 3.4 66.8 1.0 FE A:FE2202 3.4 84.6 1.0 OE1 A:GLU153 3.8 74.1 1.0 N D:SER88 4.0 95.0 1.0 OE2 A:GLU153 4.1 81.9 1.0 CG A:GLU116 4.2 62.9 1.0 NE2 D:HIS89 4.2 66.1 1.0 CD A:GLU153 4.3 75.4 1.0 OE2 A:GLU102 4.4 0.2 1.0 OE1 A:GLU102 4.4 0.9 1.0 CG A:GLU113 4.5 59.4 1.0 CD2 D:HIS89 4.5 73.8 1.0 CG A:GLU105 4.6 0.8 1.0 CB A:GLU105 4.8 0.7 1.0 CA D:SER88 4.8 92.1 1.0 CD A:GLU102 4.8 0.6 1.0

Zinc binding site 3 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn204 b:95.5 occ:1.00 NE2 A:HIS89 1.9 94.2 1.0 OE1 D:GLU105 1.9 95.7 1.0 OE1 D:GLU102 2.1 0.8 1.0 O D:HOH301 2.4 35.9 1.0 CD D:GLU105 2.5 87.7 1.0 OE2 D:GLU105 2.6 95.3 1.0 CE1 A:HIS89 2.8 0.1 1.0 CD2 A:HIS89 2.9 0.7 1.0 CD D:GLU102 3.0 88.5 1.0 OE2 D:GLU102 3.2 82.0 1.0 FE D:FE2201 3.5 66.6 1.0 ZN A:ZN205 3.5 72.6 1.0 CG D:GLU105 3.8 90.0 1.0 ND1 A:HIS89 3.9 0.9 1.0 OE1 D:GLU153 3.9 68.2 1.0 CG A:HIS89 4.0 0.1 1.0 OE1 D:GLU113 4.0 59.8 1.0 OE2 D:GLU113 4.0 53.8 1.0 N A:GLY87 4.1 87.6 1.0 O A:GLY87 4.1 73.5 1.0 CB D:GLU105 4.2 90.7 1.0 CG D:GLU102 4.3 85.1 1.0 CD D:GLU113 4.4 57.1 1.0 CA D:GLU102 4.4 0.4 1.0 OE2 D:GLU153 4.4 59.8 1.0 CD D:GLU153 4.5 65.1 1.0 CB D:GLU102 4.7 98.7 1.0 O D:ARG101 4.8 0.1 1.0 OE2 D:GLU116 4.8 56.0 1.0 C A:GLY87 4.8 95.0 1.0 OE1 D:GLU116 4.9 88.6 1.0 N D:GLU102 5.0 0.7 1.0

Zinc binding site 4 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 4 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ A:Zn205 b:72.6 occ:1.00 OE1 D:GLU116 1.8 88.6 1.0 OE2 D:GLU113 1.9 53.8 1.0 O D:HOH301 1.9 35.9 1.0 CD D:GLU116 2.6 75.0 1.0 O A:GLY87 2.6 73.5 1.0 N A:GLY87 2.6 87.6 1.0 OE1 D:GLU105 2.7 95.7 1.0 OE2 D:GLU116 2.8 56.0 1.0 CD D:GLU113 2.9 57.1 1.0 CA A:GLY87 3.0 94.4 1.0 C A:GLY87 3.2 95.0 1.0 OE1 D:GLU113 3.3 59.8 1.0 FE D:FE2201 3.3 66.6 1.0 ZN A:ZN204 3.5 95.5 1.0 OE1 D:GLU153 3.9 68.2 1.0 CD D:GLU105 3.9 87.7 1.0 CG D:GLU116 4.0 66.9 1.0 CG D:GLU113 4.2 59.7 1.0 N A:SER88 4.6 97.8 1.0 NE2 A:HIS89 4.6 94.2 1.0 OG1 D:THR112 4.6 89.6 1.0 CG D:GLU105 4.6 90.0 1.0 OE2 D:GLU102 4.7 82.0 1.0 CD D:GLU153 4.7 65.1 1.0 OE2 D:GLU153 4.7 59.8 1.0 CD2 A:HIS89 4.8 0.7 1.0 CB D:GLU105 4.8 90.7 1.0 CA D:GLU113 4.8 83.5 1.0 OE2 D:GLU105 4.9 95.3 1.0

Zinc binding site 5 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 5 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ B:Zn201 b:86.5 occ:1.00 OE2 B:GLU105 1.8 74.4 1.0 NE2 C:HIS89 1.8 1.0 1.0 O B:HOH301 2.0 54.4 1.0 OE1 B:GLU105 2.3 61.4 1.0 CD B:GLU105 2.3 76.7 1.0 OE1 B:GLU102 2.4 0.6 1.0 CE1 C:HIS89 2.8 0.2 1.0 CD2 C:HIS89 2.9 0.2 1.0 CD B:GLU102 3.0 0.6 1.0 OE2 B:GLU102 3.1 93.7 1.0 ZN B:ZN203 3.3 95.8 1.0 FE B:FE2202 3.6 88.2 1.0 O C:GLY87 3.8 0.4 1.0 OE2 B:GLU113 3.8 0.1 1.0 CG B:GLU105 3.8 80.8 1.0 ND1 C:HIS89 3.9 0.0 1.0 CG C:HIS89 4.0 0.5 1.0 OE2 B:GLU153 4.0 0.7 1.0 OE1 B:GLU153 4.1 0.0 1.0 CG B:GLU102 4.4 0.9 1.0 CG B:ARG101 4.4 0.8 1.0 OE1 B:GLU113 4.4 0.6 1.0 CD B:GLU153 4.4 0.0 1.0 CD B:GLU113 4.5 0.6 1.0 CD B:ARG101 4.5 0.6 1.0 CB B:GLU105 4.5 91.0 1.0 CA B:GLU102 4.6 0.6 1.0 CB B:GLU102 4.8 0.6 1.0 OE2 B:GLU116 4.8 72.3 1.0 OE1 B:GLU116 4.9 74.2 1.0

Zinc binding site 6 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 6 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ B:Zn203 b:95.8 occ:1.00 O C:GLY87 1.8 0.4 1.0 O B:HOH301 2.0 54.4 1.0 OE2 B:GLU113 2.0 0.1 1.0 OE1 B:GLU116 2.3 74.2 1.0 OE1 B:GLU105 2.5 61.4 1.0 N C:GLY87 2.6 1.0 1.0 C C:GLY87 2.6 0.3 1.0 CA C:GLY87 3.0 0.8 1.0 CD B:GLU113 3.1 0.6 1.0 CD B:GLU116 3.2 77.2 1.0 CD B:GLU105 3.3 76.7 1.0 ZN B:ZN201 3.3 86.5 1.0 OE2 B:GLU116 3.4 72.3 1.0 FE B:FE2202 3.6 88.2 1.0 OE1 B:GLU113 3.7 0.6 1.0 N C:SER88 3.8 0.4 1.0 OE2 B:GLU105 3.9 74.4 1.0 CG B:GLU105 4.2 80.8 1.0 OE2 B:GLU153 4.2 0.7 1.0 CG B:GLU113 4.3 97.9 1.0 CD2 C:HIS89 4.3 0.2 1.0 NE2 C:HIS89 4.3 1.0 1.0 CA C:SER88 4.5 0.2 1.0 CB B:GLU105 4.6 91.0 1.0 CG2 B:THR112 4.6 0.7 1.0 CG B:GLU116 4.6 79.9 1.0 OE2 B:GLU102 4.6 93.7 1.0 OE1 B:GLU153 4.7 0.0 1.0 O C:SER88 4.7 0.8 1.0 C C:SER88 4.9 0.1 1.0 CD B:GLU153 4.9 0.0 1.0

Zinc binding site 7 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 7 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ B:Zn204 b:1.0 occ:1.00 OE1 B:GLU91 1.6 0.5 1.0 CD B:GLU91 2.7 0.6 1.0 NH1 C:ARG101 2.8 0.1 1.0 OE2 C:GLU98 3.0 0.7 1.0 CZ C:ARG101 3.1 0.4 1.0 OE2 B:GLU91 3.2 0.9 1.0 ND1 B:HIS89 3.3 1.0 1.0 OE1 C:GLU98 3.3 0.1 1.0 NE C:ARG101 3.5 0.3 1.0 CD C:GLU98 3.5 0.1 1.0 CB B:HIS89 3.6 0.4 1.0 NH2 C:ARG101 3.7 0.1 1.0 CG B:HIS89 3.7 0.6 1.0 CD C:ARG101 3.8 0.9 1.0 CG B:GLU91 4.0 0.4 1.0 CE1 B:HIS89 4.2 0.7 1.0 CD2 B:HIS89 4.8 0.3 1.0 CG C:GLU98 4.9 0.4 1.0 CA B:HIS89 5.0 0.2 1.0

Zinc binding site 8 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 8 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ B:Zn205 b:90.5 occ:1.00 NE2 B:HIS89 1.8 0.2 1.0 O C:HOH301 1.9 55.8 1.0 OE2 C:GLU102 2.0 81.5 1.0 CE1 B:HIS89 2.5 0.7 1.0 OE2 C:GLU105 2.5 88.5 1.0 CD2 B:HIS89 2.8 0.3 1.0 O B:GLY87 2.8 82.6 1.0 OE1 C:GLU105 2.9 71.6 1.0 CD C:GLU102 3.0 85.8 1.0 CD C:GLU105 3.1 0.5 1.0 FE C:FE2202 3.2 0.2 1.0 ZN B:ZN206 3.3 0.5 1.0 OE1 C:GLU102 3.3 81.4 1.0 OE1 C:GLU153 3.5 0.1 1.0 ND1 B:HIS89 3.5 1.0 1.0 CG B:HIS89 3.7 0.6 1.0 OE2 C:GLU153 3.7 0.1 1.0 CD C:GLU153 3.9 0.3 1.0 OE2 C:GLU113 4.1 0.6 1.0 C B:GLY87 4.1 86.2 1.0 OE1 C:GLU116 4.3 83.5 1.0 CG C:GLU102 4.3 0.6 1.0 CG C:GLU105 4.6 96.0 1.0 OE1 C:GLU113 4.6 99.3 1.0 CD C:GLU113 4.7 0.3 1.0 OE2 C:GLU116 4.8 81.6 1.0 CD C:ARG101 4.8 0.9 1.0 CG C:ARG101 4.8 0.7 1.0 N B:GLY87 4.8 96.0 1.0 N B:SER88 4.9 99.6 1.0 CD C:GLU116 5.0 91.7 1.0 CA B:SER88 5.0 0.1 1.0 CA B:GLY87 5.0 93.5 1.0

Zinc binding site 9 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 9 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ B:Zn206 b:0.5 occ:1.00 OE1 C:GLU113 1.9 99.3 1.0 O B:GLY87 1.9 82.6 1.0 O C:HOH301 2.0 55.8 1.0 OE2 C:GLU116 2.3 81.6 1.0 C B:GLY87 2.4 86.2 1.0 CA B:GLY87 2.6 93.5 1.0 CD C:GLU113 2.7 0.3 1.0 OE1 C:GLU105 2.8 71.6 1.0 OE1 C:GLU116 2.9 83.5 1.0 CD C:GLU116 2.9 91.7 1.0 OE2 C:GLU113 3.0 0.6 1.0 N B:GLY87 3.1 96.0 1.0 ZN B:ZN205 3.3 90.5 1.0 CD C:GLU105 3.4 0.5 1.0 N B:SER88 3.6 99.6 1.0 FE C:FE2202 3.6 0.2 1.0 OE2 C:GLU105 3.9 88.5 1.0 OE1 C:GLU153 4.1 0.1 1.0 CG C:GLU113 4.1 95.3 1.0 CG2 C:THR112 4.3 0.1 1.0 CG C:GLU116 4.4 90.4 1.0 NE2 B:HIS89 4.4 0.2 1.0 CG C:GLU105 4.4 96.0 1.0 CB C:GLU105 4.5 98.8 1.0 CA B:SER88 4.5 0.1 1.0 CD2 B:HIS89 4.7 0.3 1.0 CA C:GLU113 4.7 0.7 1.0 OE2 C:GLU102 4.8 81.5 1.0 N C:GLU113 4.8 0.3 1.0 OE1 C:GLU102 4.9 81.4 1.0 OE2 C:GLU153 4.9 0.1 1.0 CD C:GLU153 4.9 0.3 1.0

Zinc binding site 10 out of 20 in the Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 10 of Crystal Structure of Cytoplasmic Metal Binding Domain with Iron Ions within 5.0Å range: probe atom residue distance (Å) B Occ C:Zn201 b:0.5 occ:1.00 OE1 C:GLU91 1.9 0.3 1.0 ND1 C:HIS89 2.3 0.0 1.0 CB C:HIS89 2.6 0.0 1.0 CD C:GLU91 2.6 0.8 1.0 CG C:HIS89 2.7 0.5 1.0 OE2 C:GLU91 2.8 0.1 1.0 CE1 C:HIS89 3.5 0.2 1.0 OE1 B:GLU98 3.6 0.5 1.0 CA C:HIS89 3.7 0.0 1.0 OE2 B:GLU98 4.0 0.3 1.0 CD2 C:HIS89 4.0 0.2 1.0 CG C:GLU91 4.1 0.4 1.0 C C:HIS89 4.1 0.3 1.0 CD B:GLU98 4.2 0.9 1.0 NE2 C:HIS89 4.3 1.0 1.0 O C:HIS89 4.4 0.8 1.0 CD B:ARG101 4.6 0.6 1.0 NH2 B:ARG101 4.7 0.7 1.0 N C:SER90 4.8 0.4 1.0 NE B:ARG101 4.8 0.0 1.0 CZ B:ARG101 4.9 1.0 1.0 N C:HIS89 5.0 0.9 1.0 N C:GLU91 5.0 0.6 1.0

T.Kato, K.Kumazaki, M.Wada, R.Taniguchi, T.Nakane, K.Yamashita, K.Hirata, R.Ishitani, K.Ito, T.Nishizawa, O.Nureki. Crystal Structure of Plant Vacuolar Iron Transporter VIT1. Nat Plants V. 5 308 2019.
ISSN: ESSN 2055-0278
PubMed: 30742036
DOI: 10.1038/S41477-019-0367-2