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Tungsten in PDB 9fp4: FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate

Protein crystallography data

The structure of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate, PDB code: 9fp4 was solved by A.Aderemi, M.Snee, C.Levy, D.Leys, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 54.13 / 1.45
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 89.856, 92.161, 100.279, 90, 90, 90
R / Rfree (%) 11.5 / 14.6

Other elements in 9fp4:

The structure of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate also contains other interesting chemical elements:

Tellurium (Te) 2 atoms

Tungsten Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 12;

Binding sites:

The binding sites of Tungsten atom in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate (pdb code 9fp4). This binding sites where shown within 5.0 Angstroms radius around Tungsten atom.
In total 12 binding sites of Tungsten where determined in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate, PDB code: 9fp4:
Jump to Tungsten binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Tungsten binding site 1 out of 12 in 9fp4

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Tungsten binding site 1 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 1 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W401

b:16.0
occ:1.00
 W1 A:TEW401 0.0 16.0 1.0
O5 A:TEW401 1.7 15.6 1.0
O6 A:TEW401 1.7 15.4 1.0
O3 A:TEW401 2.0 18.7 1.0
O4 A:TEW401 2.0 14.1 1.0
O2 A:TEW401 2.2 16.2 1.0
O1 A:TEW401 2.3 17.9 1.0
TE1 A:TEW401 3.3 16.9 1.0
W3 A:TEW401 3.3 14.7 1.0
W2 A:TEW401 3.3 18.5 1.0
O15 A:TEW401 3.7 15.7 1.0
O8 A:TEW401 3.7 20.2 1.0
O A:HOH599 3.7 35.5 1.0
O A:HOH532 3.7 15.5 1.0
O7 A:TEW401 3.8 18.3 1.0
N A:GLY214 4.0 15.7 1.0
O13 A:TEW401 4.0 15.4 1.0
N A:SER213 4.1 14.7 1.0
O A:HOH616 4.3 35.0 1.0
C A:SER213 4.4 16.6 1.0
OG A:SER217 4.5 15.8 1.0
CA A:GLY214 4.6 15.3 1.0
O9 A:TEW401 4.6 22.9 1.0
O14 A:TEW401 4.6 14.4 1.0
CA A:SER213 4.6 16.2 1.0
CB A:SER217 4.6 15.5 1.0
O16 A:TEW401 4.7 16.6 1.0
O11 A:TEW401 4.8 14.4 1.0
O10 A:TEW401 4.8 20.5 1.0
CB A:SER213 4.8 19.6 1.0

Tungsten binding site 2 out of 12 in 9fp4

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Tungsten binding site 2 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 2 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W401

b:18.5
occ:1.00
 W2 A:TEW401 0.0 18.5 1.0
O8 A:TEW401 1.7 20.2 1.0
O9 A:TEW401 1.8 22.9 1.0
O3 A:TEW401 1.9 18.7 1.0
O10 A:TEW401 2.0 20.5 1.0
O7 A:TEW401 2.2 18.3 1.0
O1 A:TEW401 2.3 17.9 1.0
TE1 A:TEW401 3.3 16.9 1.0
W1 A:TEW401 3.3 16.0 1.0
W4 A:TEW401 3.3 17.8 1.0
O19 A:TEW401 3.7 20.9 1.0
O2 A:TEW401 3.7 16.2 1.0
O6 A:TEW401 3.8 15.4 1.0
O A:HOH527 3.9 43.8 1.0
O12 A:TEW401 4.0 16.4 1.0
O A:HOH694 4.2 35.2 1.0
O A:HOH744 4.2 37.4 1.0
O A:HOH787 4.2 44.4 1.0
CB A:SER213 4.3 19.6 1.0
O A:HOH607 4.4 41.6 1.0
O18 A:TEW401 4.4 19.7 1.0
O5 A:TEW401 4.5 15.6 1.0
O A:HOH616 4.6 35.0 1.0
O17 A:TEW401 4.7 16.0 1.0
O A:HOH599 4.7 35.5 1.0
O11 A:TEW401 4.8 14.4 1.0
O4 A:TEW401 4.8 14.1 1.0

Tungsten binding site 3 out of 12 in 9fp4

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Tungsten binding site 3 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 3 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W401

b:14.7
occ:1.00
 W3 A:TEW401 0.0 14.7 1.0
O16 A:TEW401 1.7 16.6 1.0
O15 A:TEW401 1.7 15.7 1.0
O4 A:TEW401 1.9 14.1 1.0
O14 A:TEW401 1.9 14.4 1.0
O13 A:TEW401 2.3 15.4 1.0
O2 A:TEW401 2.3 16.2 1.0
W1 A:TEW401 3.3 16.0 1.0
W6 A:TEW401 3.3 14.9 1.0
TE1 A:TEW401 3.3 16.9 1.0
O5 A:TEW401 3.7 15.6 1.0
O31 A:TEW401 3.8 16.6 1.0
O11 A:TEW401 3.8 14.4 1.0
O1 A:TEW401 3.9 17.9 1.0
CA A:GLY214 4.0 15.3 1.0
N3 A:IMD402 4.1 17.0 1.0
CB A:GLN216 4.2 14.8 1.0
N A:GLN216 4.3 13.9 1.0
C A:GLY214 4.3 15.7 1.0
N A:SER217 4.3 13.3 1.0
O A:HOH599 4.4 35.5 1.0
CE1 A:TYR161 4.4 15.2 1.0
OG A:SER217 4.4 15.8 1.0
NE2 A:GLN216 4.4 16.6 1.0
OH A:TYR161 4.5 15.4 1.0
N A:GLY214 4.5 15.7 1.0
CZ A:TYR161 4.5 15.4 1.0
O6 A:TEW401 4.5 15.4 1.0
C2 A:IMD402 4.5 16.2 1.0
N A:PRO215 4.6 15.4 1.0
O23 A:TEW401 4.6 13.9 1.0
O20 A:TEW401 4.7 15.5 1.0
CG A:GLN216 4.7 15.7 1.0
O A:GLY214 4.7 16.0 1.0
CA A:GLN216 4.7 13.7 1.0
O3 A:TEW401 4.7 18.7 1.0
CB A:SER217 4.8 15.5 1.0
CD A:PRO215 4.8 15.8 1.0
O7 A:TEW401 4.9 18.3 1.0

Tungsten binding site 4 out of 12 in 9fp4

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Tungsten binding site 4 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 4 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W401

b:17.8
occ:1.00
 W4 A:TEW401 0.0 17.8 1.0
O18 A:TEW401 1.6 19.7 1.0
O19 A:TEW401 1.8 20.9 1.0
O17 A:TEW401 1.9 16.0 1.0
O10 A:TEW401 1.9 20.5 1.0
O7 A:TEW401 2.3 18.3 1.0
O12 A:TEW401 2.3 16.4 1.0
W5 A:TEW401 3.3 15.5 1.0
W2 A:TEW401 3.3 18.5 1.0
TE1 A:TEW401 3.3 16.9 1.0
O9 A:TEW401 3.7 22.9 1.0
O11 A:TEW401 3.7 14.4 1.0
O21 A:TEW401 3.8 15.9 1.0
O1 A:TEW401 3.9 17.9 1.0
O A:HOH567 4.0 30.3 1.0
O A:HOH527 4.1 43.8 1.0
O A:HOH744 4.2 37.4 1.0
N4 A:MES403 4.3 24.1 0.5
C6 A:MES403 4.3 22.6 0.5
O A:HOH787 4.4 44.4 1.0
O8 A:TEW401 4.4 20.2 1.0
O22 A:TEW401 4.5 13.7 1.0
C2 A:MES403 4.6 25.2 0.5
C5 A:MES403 4.7 24.0 0.5
O3 A:TEW401 4.7 18.7 1.0
O20 A:TEW401 4.8 15.5 1.0
O2 A:TEW401 4.9 16.2 1.0
C3 A:MES403 4.9 25.4 0.5
O1 A:MES403 5.0 24.5 0.5

Tungsten binding site 5 out of 12 in 9fp4

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Tungsten binding site 5 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 5 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W401

b:15.5
occ:1.00
 W5 A:TEW401 0.0 15.5 1.0
O21 A:TEW401 1.7 15.9 1.0
O22 A:TEW401 1.8 13.7 1.0
O17 A:TEW401 2.0 16.0 1.0
O20 A:TEW401 2.0 15.5 1.0
O12 A:TEW401 2.2 16.4 1.0
O11 A:TEW401 2.3 14.4 1.0
W4 A:TEW401 3.3 17.8 1.0
TE1 A:TEW401 3.3 16.9 1.0
W6 A:TEW401 3.3 14.9 1.0
O23 A:TEW401 3.7 13.9 1.0
O18 A:TEW401 3.7 19.7 1.0
O13 A:TEW401 3.8 15.4 1.0
O7 A:TEW401 3.8 18.3 1.0
O A:HOH567 4.1 30.3 1.0
O31 A:TEW401 4.5 16.6 1.0
O19 A:TEW401 4.6 20.9 1.0
O10 A:TEW401 4.7 20.5 1.0
O14 A:TEW401 4.8 14.4 1.0
O2 A:TEW401 4.9 16.2 1.0
O1 A:TEW401 5.0 17.9 1.0

Tungsten binding site 6 out of 12 in 9fp4

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Tungsten binding site 6 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 6 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W401

b:14.9
occ:1.00
 W6 A:TEW401 0.0 14.9 1.0
O31 A:TEW401 1.7 16.6 1.0
O23 A:TEW401 1.8 13.9 1.0
O20 A:TEW401 1.9 15.5 1.0
O14 A:TEW401 2.0 14.4 1.0
O13 A:TEW401 2.2 15.4 1.0
O11 A:TEW401 2.3 14.4 1.0
W3 A:TEW401 3.3 14.7 1.0
TE1 A:TEW401 3.3 16.9 1.0
W5 A:TEW401 3.3 15.5 1.0
O16 A:TEW401 3.6 16.6 1.0
O22 A:TEW401 3.7 13.7 1.0
O2 A:TEW401 3.8 16.2 1.0
O12 A:TEW401 3.9 16.4 1.0
N3 A:IMD402 4.1 17.0 1.0
C2 A:IMD402 4.3 16.2 1.0
CD A:PRO215 4.4 15.8 1.0
O15 A:TEW401 4.5 15.7 1.0
O21 A:TEW401 4.6 15.9 1.0
O17 A:TEW401 4.7 16.0 1.0
O4 A:TEW401 4.7 14.1 1.0
NE2 A:GLN216 4.7 16.6 1.0
O7 A:TEW401 4.9 18.3 1.0
CG A:PRO215 5.0 16.6 1.0
CA A:GLY214 5.0 15.3 1.0

Tungsten binding site 7 out of 12 in 9fp4

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Tungsten binding site 7 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 7 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
B:W401

b:14.8
occ:1.00
 W1 B:TEW401 0.0 14.8 1.0
O6 B:TEW401 1.7 16.7 1.0
O5 B:TEW401 1.7 14.9 1.0
O4 B:TEW401 2.0 16.2 1.0
O3 B:TEW401 2.0 14.0 1.0
O1 B:TEW401 2.2 15.4 1.0
O2 B:TEW401 2.2 15.6 1.0
W2 B:TEW401 3.3 14.5 1.0
W3 B:TEW401 3.3 15.0 1.0
TE1 B:TEW401 3.3 16.4 1.0
O8 B:TEW401 3.6 17.0 1.0
O15 B:TEW401 3.7 14.8 1.0
O7 B:TEW401 3.7 16.5 1.0
O13 B:TEW401 3.9 16.9 1.0
N1 B:IMD402 4.0 16.5 1.0
O B:HOH563 4.1 17.2 1.0
C2 B:IMD402 4.4 16.8 1.0
CD B:PRO215 4.4 15.4 1.0
O9 B:TEW401 4.5 17.0 1.0
O16 B:TEW401 4.5 15.9 1.0
O14 B:TEW401 4.6 16.7 1.0
O10 B:TEW401 4.7 15.5 1.0
NE2 B:GLN216 4.7 16.7 1.0
O11 B:TEW401 4.9 17.8 1.0
CA B:GLY214 4.9 14.6 1.0
CG B:PRO215 5.0 17.2 1.0

Tungsten binding site 8 out of 12 in 9fp4

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Tungsten binding site 8 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 8 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
B:W401

b:14.5
occ:1.00
 W2 B:TEW401 0.0 14.5 1.0
O8 B:TEW401 1.7 17.0 1.0
O9 B:TEW401 1.7 17.0 1.0
O10 B:TEW401 1.9 15.5 1.0
O3 B:TEW401 1.9 14.0 1.0
O7 B:TEW401 2.3 16.5 1.0
O1 B:TEW401 2.3 15.4 1.0
W4 B:TEW401 3.3 15.6 1.0
W1 B:TEW401 3.3 14.8 1.0
TE1 B:TEW401 3.3 16.4 1.0
O19 B:TEW401 3.7 18.4 1.0
O2 B:TEW401 3.8 15.6 1.0
O6 B:TEW401 3.9 16.7 1.0
O12 B:TEW401 3.9 17.2 1.0
CA B:GLY214 3.9 14.6 1.0
N1 B:IMD402 4.0 16.5 1.0
C B:GLY214 4.2 14.8 1.0
CB B:GLN216 4.2 15.2 1.0
O B:HOH738 4.3 34.3 1.0
N B:GLN216 4.3 14.4 1.0
N B:SER217 4.3 14.2 1.0
NE2 B:GLN216 4.4 16.7 1.0
CE1 B:TYR161 4.4 15.2 1.0
OH B:TYR161 4.4 14.8 1.0
OG B:SER217 4.5 16.4 1.0
CZ B:TYR161 4.5 14.8 1.0
N B:GLY214 4.5 15.0 1.0
O18 B:TEW401 4.5 16.3 1.0
C2 B:IMD402 4.5 16.8 1.0
N B:PRO215 4.6 15.5 1.0
O5 B:TEW401 4.6 14.9 1.0
CG B:GLN216 4.7 17.0 1.0
O B:GLY214 4.7 15.7 1.0
O4 B:TEW401 4.7 16.2 1.0
CA B:GLN216 4.7 15.0 1.0
CD B:PRO215 4.8 15.4 1.0
O17 B:TEW401 4.8 19.3 1.0
CB B:SER217 4.8 15.0 1.0
O11 B:TEW401 4.9 17.8 1.0
O13 B:TEW401 5.0 16.9 1.0

Tungsten binding site 9 out of 12 in 9fp4

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Tungsten binding site 9 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 9 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
B:W401

b:15.0
occ:1.00
 W3 B:TEW401 0.0 15.0 1.0
O16 B:TEW401 1.7 15.9 1.0
O15 B:TEW401 1.8 14.8 1.0
O14 B:TEW401 1.9 16.7 1.0
O4 B:TEW401 2.0 16.2 1.0
O2 B:TEW401 2.2 15.6 1.0
O13 B:TEW401 2.2 16.9 1.0
W6 B:TEW401 3.3 17.1 1.0
TE1 B:TEW401 3.3 16.4 1.0
W1 B:TEW401 3.3 14.8 1.0
O31 B:TEW401 3.6 19.2 1.0
O5 B:TEW401 3.7 14.9 1.0
O1 B:TEW401 3.8 15.4 1.0
O11 B:TEW401 3.8 17.8 1.0
O B:HOH543 4.0 30.3 1.0
O6 B:TEW401 4.5 16.7 1.0
O23 B:TEW401 4.6 21.0 1.0
O20 B:TEW401 4.8 19.2 1.0
O3 B:TEW401 4.8 14.0 1.0
O7 B:TEW401 4.9 16.5 1.0
O3S B:MES403 4.9 22.5 0.5
C8 B:MES403 5.0 21.7 0.5
O12 B:TEW401 5.0 17.2 1.0

Tungsten binding site 10 out of 12 in 9fp4

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Tungsten binding site 10 out of 12 in the FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 10 of FGD2 (RV0132C) From Mycobacterium Tuberculosis Crystallised with Anderson-Evans Polyoxotungstate within 5.0Å range:
probe atom residue distance (Å) B Occ
B:W401

b:15.6
occ:1.00
 W4 B:TEW401 0.0 15.6 1.0
O19 B:TEW401 1.7 18.4 1.0
O18 B:TEW401 1.8 16.3 1.0
O10 B:TEW401 1.9 15.5 1.0
O17 B:TEW401 2.0 19.3 1.0
O7 B:TEW401 2.2 16.5 1.0
O12 B:TEW401 2.3 17.2 1.0
TE1 B:TEW401 3.3 16.4 1.0
W2 B:TEW401 3.3 14.5 1.0
W5 B:TEW401 3.3 17.7 1.0
O B:HOH738 3.7 34.3 1.0
O9 B:TEW401 3.7 17.0 1.0
O21 B:TEW401 3.7 21.7 1.0
O B:HOH548 3.8 14.6 1.0
O11 B:TEW401 3.8 17.8 1.0
O1 B:TEW401 3.9 15.4 1.0
N B:GLY214 4.0 15.0 1.0
N B:SER213 4.0 15.6 1.0
O B:HOH627 4.3 36.2 1.0
OG B:SER217 4.5 16.4 1.0
C B:SER213 4.5 17.2 1.0
CA B:GLY214 4.5 14.6 1.0
O22 B:TEW401 4.6 22.6 1.0
O3 B:TEW401 4.6 14.0 1.0
CA B:SER213 4.6 16.9 1.0
O8 B:TEW401 4.7 17.0 1.0
CB B:SER217 4.7 15.0 1.0
O20 B:TEW401 4.7 19.2 1.0
CB B:SER213 4.8 19.7 1.0
O2 B:TEW401 4.8 15.6 1.0
O B:HOH923 4.9 44.8 1.0
O13 B:TEW401 5.0 16.9 1.0
CA B:ALA212 5.0 14.6 1.0

Reference:

A.Aderemi, M.Snee, D.Leys. To Be Published To Be Published.
Page generated: Tue Aug 19 16:58:43 2025

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