Tungsten in PDB 7zqq: Molybdenum Storage Protein - LB131H

The structure of Molybdenum Storage Protein - LB131H, PDB code: 7zqq was solved by U.Ermler, I.Aziz, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	45.85 / 1.75
Space group	P 63 2 2
Cell size a, b, c (Å), α, β, γ (°)	115.04, 115.04, 234.41, 90, 90, 120
R / Rfree (%)	20.7 / 22

The structure of Molybdenum Storage Protein - LB131H also contains other interesting chemical elements:

Chlorine	(Cl)	1 atom
Magnesium	(Mg)	1 atom

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 20; Page 3, Binding sites: 21 - 30; Page 4, Binding sites: 31 - 33;

Binding sites:

The binding sites of Tungsten atom in the Molybdenum Storage Protein - LB131H (pdb code 7zqq). This binding sites where shown within 5.0 Angstroms radius around Tungsten atom.
In total 33 binding sites of Tungsten where determined in the Molybdenum Storage Protein - LB131H, PDB code: 7zqq:
Jump to Tungsten binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Tungsten binding site 1 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 1 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W303 b:204.3 occ:1.00 W A:UNL303 0.0 204.3 1.0 O3 A:UNL303 1.7 203.6 1.0 O1 A:UNL303 2.1 201.9 1.0 NE2 A:HIS140 2.3 43.4 1.0 O4 A:UNL303 2.4 140.6 0.3 O2 A:UNL303 2.5 203.7 1.0 CE1 A:HIS140 3.2 44.3 1.0 CD2 A:HIS140 3.3 41.1 1.0 ND1 A:HIS140 4.4 43.5 1.0 CG A:HIS140 4.4 36.2 1.0 CG2 A:THR132 4.6 44.3 1.0

Tungsten binding site 2 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 2 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W304 b:502.8 occ:1.00 W A:UNL304 0.0 502.8 1.0 O4 A:UNL304 1.7 509.9 0.3 O3 A:UNL304 1.8 497.1 1.0 O2 A:UNL304 1.9 509.7 1.0 O1 A:UNL304 2.0 511.1 1.0 O A:HOH482 3.6 64.1 1.0 OG1 A:THR132 3.9 47.7 1.0 CB A:GLU129 3.9 189.4 1.0 O112 A:UNL305 4.1 267.5 0.0 CG A:GLU129 4.1 252.9 1.0 O33 A:UNL305 4.2 230.2 0.0 CD A:PRO131 4.5 40.3 1.0 CB A:PRO131 4.5 42.2 1.0 CG A:PRO131 4.6 42.9 1.0 O111 A:UNL305 4.7 247.7 0.0 N A:THR132 4.8 36.9 1.0

Tungsten binding site 3 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 3 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W305 b:233.3 occ:0.70 W1 A:UNL305 0.0 233.3 0.7 O32 A:UNL305 1.8 232.8 0.0 O15 A:UNL305 2.0 231.1 0.0 O16 A:UNL305 2.0 237.9 0.0 O72 A:UNL305 2.1 230.2 0.0 O14 A:UNL305 2.2 240.7 0.0 O13 A:UNL305 2.4 235.1 0.0 W13 A:UNL305 2.8 238.4 0.7 W7 A:UNL305 3.1 227.2 0.7 W3 A:UNL305 3.2 233.3 0.7 O71 A:UNL305 3.2 234.0 0.0 W12 A:UNL305 3.3 231.0 0.7 O31 A:UNL305 3.3 230.1 0.0 O133 A:UNL305 3.5 239.8 0.0 P A:UNL305 3.7 229.8 0.7 O121 A:UNL305 3.8 235.5 0.0 O82 A:UNL305 3.8 220.0 0.0 O74 B:UNL302 4.0 157.2 0.0 W9 A:UNL305 4.2 245.3 0.7 O131 A:UNL305 4.3 239.4 0.0 W2 A:UNL305 4.3 222.8 0.7 O21 A:UNL305 4.3 218.4 0.0 O23 A:UNL305 4.4 220.9 0.0 O132 A:UNL305 4.4 238.9 0.0 CD2 A:HIS130 4.4 52.4 1.0 O92 A:UNL305 4.5 235.9 0.0 O33 A:UNL305 4.5 230.2 0.0 CE1 A:HIS156 4.5 46.4 1.0 OE2 A:GLU129 4.6 280.1 1.0 O75 B:UNL302 4.7 157.2 0.0 O12 A:UNL305 4.7 242.1 0.0 O A:HOH417 4.8 40.2 1.0 O74 A:UNL305 4.8 236.6 0.0 O45 A:UNL305 4.8 254.5 0.0 O123 A:UNL305 4.9 240.4 0.0 W8 A:UNL305 5.0 209.1 0.7 O111 A:UNL305 5.0 247.7 0.0

Tungsten binding site 4 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 4 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W305 b:222.5 occ:0.70 W10 A:UNL305 0.0 222.5 0.7 O101 A:UNL305 1.8 222.9 0.0 O102 A:UNL305 2.0 240.6 0.0 O84 A:UNL305 2.1 213.6 0.0 O104 A:UNL305 2.2 221.6 0.0 O103 A:UNL305 2.2 224.6 0.0 OE2 A:GLU129 2.3 280.1 1.0 CD A:GLU129 2.4 276.8 1.0 OE1 A:GLU129 2.7 276.2 1.0 O111 A:UNL305 3.2 247.7 0.0 CG A:GLU129 3.3 252.9 1.0 W6 A:UNL305 3.4 223.1 0.7 W11 A:UNL305 3.4 259.7 0.7 P A:UNL305 3.5 229.8 0.7 W8 A:UNL305 3.5 209.1 0.7 O21 A:UNL305 3.8 218.4 0.0 O52 A:UNL305 3.9 221.5 0.0 O62 A:UNL305 4.0 267.4 0.0 O15 A:UNL305 4.2 231.1 0.0 CE1 A:HIS114 4.2 26.9 1.0 O71 A:UNL305 4.3 234.0 0.0 O82 A:UNL305 4.4 220.0 0.0 W7 A:UNL305 4.4 227.2 0.7 O81 A:UNL305 4.4 205.3 0.0 W3 A:UNL305 4.5 233.3 0.7 CE2 A:TYR127 4.5 27.6 1.0 O83 A:UNL305 4.5 206.5 0.0 NE2 A:HIS114 4.6 30.7 1.0 CB A:GLU129 4.7 189.4 1.0 W5 A:UNL305 4.8 218.4 0.7 O43 A:UNL305 4.8 223.9 0.0 O112 A:UNL305 4.9 267.5 0.0 O113 A:UNL305 4.9 267.5 0.0 O74 A:UNL305 4.9 236.6 0.0 O12 A:UNL305 4.9 242.1 0.0 CD2 A:TYR127 5.0 29.2 1.0 O61 A:UNL305 5.0 224.2 0.0

Tungsten binding site 5 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 5 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W305 b:259.7 occ:0.70 W11 A:UNL305 0.0 259.7 0.7 O113 A:UNL305 1.9 267.5 0.0 O112 A:UNL305 1.9 267.5 0.0 O111 A:UNL305 1.9 247.7 0.0 O102 A:UNL305 2.0 240.6 0.0 O62 A:UNL305 2.1 267.4 0.0 O103 A:UNL305 2.3 224.6 0.0 W6 A:UNL305 3.2 223.1 0.7 W10 A:UNL305 3.4 222.5 0.7 O43 A:UNL305 3.4 223.9 0.0 O104 A:UNL305 3.7 221.6 0.0 P A:UNL305 3.8 229.8 0.7 O31 A:UNL305 3.9 230.1 0.0 W3 A:UNL305 3.9 233.3 0.7 CG A:GLU129 4.1 252.9 1.0 O12 A:UNL305 4.2 242.1 0.0 O46 A:UNL305 4.3 219.1 0.0 OE2 A:GLU129 4.3 280.1 1.0 O4 A:UNL304 4.4 509.9 0.3 CD A:GLU129 4.4 276.8 1.0 O33 A:UNL305 4.4 230.2 0.0 O101 A:UNL305 4.7 222.9 0.0 W4 A:UNL305 4.8 223.5 0.7 O15 A:UNL305 4.8 231.1 0.0 O61 A:UNL305 4.8 224.2 0.0 O52 A:UNL305 4.9 221.5 0.0

Tungsten binding site 6 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 6 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W305 b:231.0 occ:0.70 W12 A:UNL305 0.0 231.0 0.7 O123 A:UNL305 2.0 240.4 0.0 O72 A:UNL305 2.0 230.2 0.0 O121 A:UNL305 2.1 235.5 0.0 O82 A:UNL305 2.1 220.0 0.0 O23 A:UNL305 2.2 220.9 0.0 O13 A:UNL305 2.2 235.1 0.0 W7 A:UNL305 3.1 227.2 0.7 W13 A:UNL305 3.2 238.4 0.7 W1 A:UNL305 3.3 233.3 0.7 W8 A:UNL305 3.5 209.1 0.7 O15 A:UNL305 3.6 231.1 0.0 O A:ALA106 3.6 20.7 1.0 W2 A:UNL305 3.6 222.8 0.7 O16 A:UNL305 3.9 237.9 0.0 O22 A:UNL305 3.9 218.2 0.0 O21 A:UNL305 4.0 218.4 0.0 O132 A:UNL305 4.0 238.9 0.0 C A:ALA106 4.0 21.8 1.0 O83 A:UNL305 4.2 206.5 0.0 O74 A:UNL305 4.2 236.6 0.0 O A:HOH417 4.2 40.2 1.0 N A:SER107 4.4 19.6 1.0 CA A:SER107 4.4 20.2 1.0 CB A:ALA106 4.4 22.9 1.0 O131 A:UNL305 4.6 239.4 0.0 O71 A:UNL305 4.6 234.0 0.0 P A:UNL305 4.7 229.8 0.7 O14 A:UNL305 4.7 240.7 0.0 OG A:SER150 4.7 20.8 1.0 CA A:GLY110 4.8 17.5 1.0 NE2 A:HIS130 4.8 52.0 1.0 CB A:SER150 4.8 18.3 1.0 O32 A:UNL305 4.8 232.8 0.0 O133 A:UNL305 4.8 239.8 0.0 CA A:ALA106 4.8 19.7 1.0 OH A:TYR127 4.9 28.5 1.0 N A:GLY110 4.9 18.0 1.0 O84 A:UNL305 4.9 213.6 0.0 CD2 A:HIS130 5.0 52.4 1.0 OE2 A:GLU129 5.0 280.1 1.0

Tungsten binding site 7 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 7 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W305 b:238.4 occ:0.70 W13 A:UNL305 0.0 238.4 0.7 O132 A:UNL305 1.8 238.9 0.0 O133 A:UNL305 1.8 239.8 0.0 O16 A:UNL305 1.8 237.9 0.0 O131 A:UNL305 1.9 239.4 0.0 O13 A:UNL305 2.1 235.1 0.0 O121 A:UNL305 2.1 235.5 0.0 W1 A:UNL305 2.8 233.3 0.7 O14 A:UNL305 3.1 240.7 0.0 W12 A:UNL305 3.2 231.0 0.7 O22 A:UNL305 3.5 218.2 0.0 O72 A:UNL305 3.6 230.2 0.0 O74 B:UNL302 3.8 157.2 0.0 W2 A:UNL305 3.8 222.8 0.7 NE2 A:HIS156 3.9 42.2 1.0 CE1 A:HIS156 3.9 46.4 1.0 O92 A:UNL305 3.9 235.9 0.0 O23 A:UNL305 4.1 220.9 0.0 O15 A:UNL305 4.2 231.1 0.0 O A:HOH417 4.3 40.2 1.0 O A:PRO103 4.3 20.9 1.0 CB A:ALA106 4.3 22.9 1.0 W9 A:UNL305 4.4 245.3 0.7 O32 A:UNL305 4.6 232.8 0.0 O91 A:UNL305 4.6 254.5 0.0 ND1 A:HIS156 4.6 44.5 1.0 CD2 A:HIS156 4.7 43.0 1.0 CB A:PRO103 4.7 24.1 1.0 CA A:PRO103 4.8 19.7 1.0 N A:SER107 4.9 19.6 1.0 O82 A:UNL305 4.9 220.0 0.0 O22 B:UNL302 5.0 69.2 0.0 O21 A:UNL305 5.0 218.4 0.0 C A:PRO103 5.0 19.8 1.0

Tungsten binding site 8 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 8 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W305 b:222.8 occ:0.70 W2 A:UNL305 0.0 222.8 0.7 O22 A:UNL305 1.7 218.2 0.0 O21 A:UNL305 1.8 218.4 0.0 O24 A:UNL305 2.0 219.4 0.0 O23 A:UNL305 2.1 220.9 0.0 O92 A:UNL305 2.2 235.9 0.0 O13 A:UNL305 2.2 235.1 0.0 P A:UNL305 3.0 229.8 0.7 W8 A:UNL305 3.1 209.1 0.7 W5 A:UNL305 3.2 218.4 0.7 O81 A:UNL305 3.2 205.3 0.0 O12 A:UNL305 3.4 242.1 0.0 W9 A:UNL305 3.5 245.3 0.7 O132 A:UNL305 3.6 238.9 0.0 W12 A:UNL305 3.6 231.0 0.7 O15 A:UNL305 3.8 231.1 0.0 W13 A:UNL305 3.8 238.4 0.7 O82 A:UNL305 3.9 220.0 0.0 O14 A:UNL305 3.9 240.7 0.0 O44 A:UNL305 4.2 236.5 0.0 O133 A:UNL305 4.2 239.8 0.0 O121 A:UNL305 4.3 235.5 0.0 O41 A:UNL305 4.3 221.5 0.0 W1 A:UNL305 4.3 233.3 0.7 CA A:SER107 4.4 20.2 1.0 CB A:SER107 4.4 23.2 0.3 CB A:SER107 4.4 22.3 0.7 OG A:SER107 4.4 25.3 0.7 O83 A:UNL305 4.6 206.5 0.0 O51 A:UNL305 4.6 214.8 0.0 O52 A:UNL305 4.6 221.5 0.0 O103 A:UNL305 4.7 224.6 0.0 O84 A:UNL305 4.7 213.6 0.0 O72 A:UNL305 4.7 230.2 0.0 O91 A:UNL305 4.8 254.5 0.0 NE2 A:GLN111 4.9 38.0 1.0 W4 A:UNL305 4.9 223.5 0.7

Tungsten binding site 9 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 9 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W305 b:233.3 occ:0.70 W3 A:UNL305 0.0 233.3 0.7 O31 A:UNL305 1.8 230.1 0.0 O33 A:UNL305 1.8 230.2 0.0 O32 A:UNL305 1.9 232.8 0.0 O71 A:UNL305 2.0 234.0 0.0 O111 A:UNL305 2.1 247.7 0.0 O15 A:UNL305 2.2 231.1 0.0 OE2 A:GLU129 3.1 280.1 1.0 W1 A:UNL305 3.2 233.3 0.7 P A:UNL305 3.3 229.8 0.7 W7 A:UNL305 3.4 227.2 0.7 O14 A:UNL305 3.6 240.7 0.0 CG A:GLU129 3.8 252.9 1.0 O103 A:UNL305 3.8 224.6 0.0 CD A:GLU129 3.9 276.8 1.0 W11 A:UNL305 3.9 259.7 0.7 CB A:GLU129 4.1 189.4 1.0 O72 A:UNL305 4.1 230.2 0.0 O113 A:UNL305 4.2 267.5 0.0 O102 A:UNL305 4.4 240.6 0.0 O1 A:UNL304 4.4 511.1 1.0 CD A:PRO131 4.5 40.3 1.0 O12 A:UNL305 4.5 242.1 0.0 W10 A:UNL305 4.5 222.5 0.7 O45 A:UNL305 4.5 254.5 0.0 O74 A:UNL305 4.7 236.6 0.0 O13 A:UNL305 4.7 235.1 0.0 O82 A:UNL305 4.8 220.0 0.0 O21 A:UNL305 4.8 218.4 0.0 W9 A:UNL305 4.9 245.3 0.7 N A:HIS130 4.9 37.0 1.0 O112 A:UNL305 4.9 267.5 0.0

Tungsten binding site 10 out of 33 in the Molybdenum Storage Protein - LB131H


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 10 of Molybdenum Storage Protein - LB131H within 5.0Å range: probe atom residue distance (Å) B Occ A:W305 b:223.5 occ:0.70 W4 A:UNL305 0.0 223.5 0.7 O46 A:UNL305 1.8 219.1 0.0 O42 A:UNL305 1.9 219.2 0.0 O41 A:UNL305 2.1 221.5 0.0 O44 A:UNL305 2.1 236.5 0.0 O43 A:UNL305 2.2 223.9 0.0 O12 A:UNL305 2.2 242.1 0.0 W9 A:UNL305 3.4 245.3 0.7 W6 A:UNL305 3.7 223.1 0.7 O45 A:UNL305 3.7 254.5 0.0 O52 A:UNL305 3.7 221.5 0.0 O113 A:UNL305 3.7 267.5 0.0 W5 A:UNL305 3.8 218.4 0.7 O92 A:UNL305 3.9 235.9 0.0 P A:UNL305 3.9 229.8 0.7 O103 A:UNL305 3.9 224.6 0.0 O21 A:UNL305 4.4 218.4 0.0 O24 A:UNL305 4.4 219.4 0.0 O91 A:UNL305 4.7 254.5 0.0 O61 A:UNL305 4.7 224.2 0.0 O62 A:UNL305 4.7 267.4 0.0 W11 A:UNL305 4.8 259.7 0.7 W2 A:UNL305 4.9 222.8 0.7 O51 A:UNL305 5.0 214.8 0.0

I.Aziz, S.Kaltwasser, K.Kayastha, R.Khera, J.Vonck, U.Ermler. The Molybdenum Storage Protein Forms and Deposits Distinct Polynuclear Tungsten Oxygen Aggregates. J.Inorg.Biochem. V. 234 11904 2022.
ISSN: ISSN 0162-0134
PubMed: 35779405
DOI: 10.1016/J.JINORGBIO.2022.111904