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Tungsten in PDB 5fhw: Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate

Enzymatic activity of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate

All present enzymatic activity of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate:
3.2.1.17;

Protein crystallography data

The structure of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate, PDB code: 5fhw was solved by L.Vandebroek, E.De Zitter, L.Van Meervelt, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 35.31 / 1.52
Space group P 43 21 2
Cell size a, b, c (Å), α, β, γ (°) 78.951, 78.951, 36.756, 90.00, 90.00, 90.00
R / Rfree (%) 16 / 18.9

Other elements in 5fhw:

The structure of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate also contains other interesting chemical elements:

Potassium (K) 2 atoms
Hafnium (Hf) 1 atom

Tungsten Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 17;

Binding sites:

The binding sites of Tungsten atom in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate (pdb code 5fhw). This binding sites where shown within 5.0 Angstroms radius around Tungsten atom.
In total 17 binding sites of Tungsten where determined in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate, PDB code: 5fhw:
Jump to Tungsten binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Tungsten binding site 1 out of 17 in 5fhw

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Tungsten binding site 1 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 1 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:23.3
occ:0.33
 W1 A:HFW201 0.0 23.3 0.3
O1 A:HFW201 1.7 13.4 0.3
O1L A:HFW201 1.7 17.9 0.3
O7 A:HFW201 1.8 13.8 0.3
O2 A:HFW201 2.0 12.4 0.3
O4 A:HFW201 2.0 14.2 0.3
O8 A:HFW201 2.3 14.1 0.3
W2 A:HFW201 3.4 10.9 0.3
HF1 A:HFW201 3.4 13.3 0.3
P1 A:HFW201 3.5 9.8 0.3
O2L A:HFW201 3.6 15.3 0.3
W8 A:HFW201 3.6 12.1 0.3
W3 A:HFW201 3.6 10.5 0.3
O9 A:HFW201 3.7 10.0 0.3
O23 A:HFW201 3.8 11.6 0.3
O A:HOH380 3.8 22.8 1.0
O4L A:HFW201 3.8 17.2 0.3
O21 A:HFW201 3.8 11.0 0.3
O A:HOH328 3.9 25.7 1.0
O A:HOH306 3.9 23.9 0.7
O5 A:HFW201 3.9 14.7 0.3
O A:HOH358 4.0 16.1 1.0
O19 A:HFW201 4.4 13.8 0.3
O20 A:HFW201 4.5 11.4 0.3
O11 A:HFW201 4.5 10.8 0.3
O10 A:HFW201 4.6 15.2 0.3
O A:HOH339 4.6 25.9 1.0
O3 A:HFW201 4.7 11.7 0.3
O3L A:HFW201 4.7 10.7 0.3
O6 A:HFW201 4.8 10.4 0.3
O22 A:HFW201 4.8 12.0 0.3
W7 A:HFW201 5.0 11.4 0.3

Tungsten binding site 2 out of 17 in 5fhw

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Tungsten binding site 2 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 2 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:11.7
occ:0.33
 W10 A:HFW201 0.0 11.7 0.3
O33 A:HFW201 1.7 13.7 0.3
O25 A:HFW201 1.8 11.0 0.3
O34 A:HFW201 1.9 12.4 0.3
O32 A:HFW201 1.9 10.3 0.3
O47 A:HFW201 2.0 14.9 0.3
O42 A:HFW201 2.3 11.2 0.3
W9 A:HFW201 3.3 12.7 0.3
P2 A:HFW201 3.5 10.3 0.3
O24 A:HFW201 3.6 12.4 0.3
O48 A:HFW201 3.6 13.5 0.3
CG2 A:THR47 3.7 19.1 1.0
W11 A:HFW201 3.7 11.8 0.3
W4 A:HFW201 3.7 10.0 0.3
O13 A:HFW201 3.7 13.7 0.3
W16 A:HFW201 3.8 13.0 0.3
O46 A:HFW201 3.8 16.0 0.3
O43 A:HFW201 3.9 12.1 0.3
O45 A:HFW201 3.9 13.9 0.3
O21 A:HFW201 4.1 11.0 0.3
O11 A:HFW201 4.3 10.8 0.3
O12 A:HFW201 4.3 17.7 0.3
CB A:THR47 4.4 21.5 1.0
O53 A:HFW201 4.4 15.3 0.3
O35 A:HFW201 4.6 15.2 0.3
O A:HOH301 4.6 9.5 0.3
O26 A:HFW201 4.6 16.5 0.3
O31 A:HFW201 4.6 12.1 0.3
O54 A:HFW201 4.7 13.8 0.3
O44 A:HFW201 4.8 12.0 0.3
O30 A:HFW201 4.8 10.9 0.3
CA A:THR47 4.9 20.1 1.0

Tungsten binding site 3 out of 17 in 5fhw

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Tungsten binding site 3 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 3 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:11.8
occ:0.33
 W11 A:HFW201 0.0 11.8 0.3
O35 A:HFW201 1.7 15.2 0.3
O34 A:HFW201 1.9 12.4 0.3
O36 A:HFW201 1.9 13.0 0.3
O48 A:HFW201 1.9 13.5 0.3
O26 A:HFW201 2.0 16.5 0.3
O43 A:HFW201 2.4 12.1 0.3
W12 A:HFW201 3.3 12.8 0.3
P2 A:HFW201 3.5 10.3 0.3
O27 A:HFW201 3.6 13.8 0.3
O47 A:HFW201 3.6 14.9 0.3
W10 A:HFW201 3.7 11.7 0.3
O A:HOH305 3.7 18.4 0.7
W16 A:HFW201 3.7 13.0 0.3
W5 A:HFW201 3.7 11.7 0.3
O13 A:HFW201 3.7 13.7 0.3
O49 A:HFW201 3.8 13.4 0.3
O42 A:HFW201 3.8 11.2 0.3
O45 A:HFW201 3.9 13.9 0.3
O22 A:HFW201 4.1 12.0 0.3
O15 A:HFW201 4.3 12.4 0.3
O25 A:HFW201 4.4 11.0 0.3
O33 A:HFW201 4.5 13.7 0.3
O14 A:HFW201 4.5 12.1 0.3
O55 A:HFW201 4.5 14.2 0.3
O37 A:HFW201 4.6 13.2 0.3
O54 A:HFW201 4.6 13.8 0.3
O38 A:HFW201 4.8 12.1 0.3
O44 A:HFW201 4.8 12.0 0.3

Tungsten binding site 4 out of 17 in 5fhw

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Tungsten binding site 4 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 4 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:12.8
occ:0.33
 W12 A:HFW201 0.0 12.8 0.3
O37 A:HFW201 1.7 13.2 0.3
O27 A:HFW201 1.8 13.8 0.3
O38 A:HFW201 1.9 12.1 0.3
O36 A:HFW201 1.9 13.0 0.3
O49 A:HFW201 2.0 13.4 0.3
O43 A:HFW201 2.3 12.1 0.3
W11 A:HFW201 3.3 11.8 0.3
P2 A:HFW201 3.5 10.3 0.3
O26 A:HFW201 3.7 16.5 0.3
W13 A:HFW201 3.7 13.1 0.3
O50 A:HFW201 3.7 11.6 0.3
W17 A:HFW201 3.7 14.4 0.3
O48 A:HFW201 3.7 13.5 0.3
W6 A:HFW201 3.8 11.7 0.3
O17 A:HFW201 3.8 12.6 0.3
O44 A:HFW201 3.8 12.0 0.3
O45 A:HFW201 3.9 13.9 0.3
O22 A:HFW201 4.2 12.0 0.3
O28 A:HFW201 4.4 11.4 0.3
O15 A:HFW201 4.4 12.4 0.3
O55 A:HFW201 4.5 14.2 0.3
O16 A:HFW201 4.5 14.5 0.3
O39 A:HFW201 4.6 15.2 0.3
O35 A:HFW201 4.6 15.2 0.3
O56 A:HFW201 4.6 14.1 0.3
O34 A:HFW201 4.7 12.4 0.3
O42 A:HFW201 4.8 11.2 0.3
W16 A:HFW201 5.0 13.0 0.3

Tungsten binding site 5 out of 17 in 5fhw

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Tungsten binding site 5 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 5 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:13.1
occ:0.33
 W13 A:HFW201 0.0 13.1 0.3
O39 A:HFW201 1.7 15.2 0.3
O28 A:HFW201 1.7 11.4 0.3
O38 A:HFW201 1.9 12.1 0.3
O40 A:HFW201 1.9 13.0 0.3
O50 A:HFW201 2.0 11.6 0.3
O44 A:HFW201 2.3 12.0 0.3
W14 A:HFW201 3.4 13.9 0.3
P2 A:HFW201 3.5 10.3 0.3
W12 A:HFW201 3.7 12.8 0.3
W17 A:HFW201 3.7 14.4 0.3
O29 A:HFW201 3.7 12.5 0.3
O49 A:HFW201 3.7 13.4 0.3
O17 A:HFW201 3.7 12.6 0.3
W7 A:HFW201 3.8 11.4 0.3
O51 A:HFW201 3.8 15.2 0.3
O43 A:HFW201 3.8 12.1 0.3
O45 A:HFW201 3.9 13.9 0.3
O23 A:HFW201 4.2 11.6 0.3
O18 A:HFW201 4.3 12.1 0.3
O27 A:HFW201 4.3 13.8 0.3
O19 A:HFW201 4.3 13.8 0.3
O57 A:HFW201 4.5 15.4 0.3
O37 A:HFW201 4.6 13.2 0.3
O41 A:HFW201 4.6 12.5 0.3
O56 A:HFW201 4.6 14.1 0.3
O42 A:HFW201 4.8 11.2 0.3
O30 A:HFW201 4.8 10.9 0.3

Tungsten binding site 6 out of 17 in 5fhw

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Tungsten binding site 6 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 6 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:13.9
occ:0.33
 W14 A:HFW201 0.0 13.9 0.3
O41 A:HFW201 1.7 12.5 0.3
O30 A:HFW201 1.9 10.9 0.3
O51 A:HFW201 1.9 15.2 0.3
O40 A:HFW201 1.9 13.0 0.3
O29 A:HFW201 1.9 12.5 0.3
O44 A:HFW201 2.4 12.0 0.3
W13 A:HFW201 3.4 13.1 0.3
P2 A:HFW201 3.5 10.3 0.3
O46 A:HFW201 3.6 16.0 0.3
O28 A:HFW201 3.6 11.4 0.3
W9 A:HFW201 3.7 12.7 0.3
W15 A:HFW201 3.7 15.4 0.3
O50 A:HFW201 3.8 11.6 0.3
W8 A:HFW201 3.8 12.1 0.3
O42 A:HFW201 3.9 11.2 0.3
O9 A:HFW201 3.9 10.0 0.3
O45 A:HFW201 3.9 13.9 0.3
O23 A:HFW201 4.2 11.6 0.3
O19 A:HFW201 4.3 13.8 0.3
O24 A:HFW201 4.3 12.4 0.3
O20 A:HFW201 4.4 11.4 0.3
O57 A:HFW201 4.4 15.4 0.3
O31 A:HFW201 4.6 12.1 0.3
O39 A:HFW201 4.6 15.2 0.3
O52 A:HFW201 4.6 13.0 0.3
O38 A:HFW201 4.8 12.1 0.3
O43 A:HFW201 4.8 12.1 0.3
O A:HOH355 4.9 28.8 1.0

Tungsten binding site 7 out of 17 in 5fhw

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Tungsten binding site 7 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 7 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:15.4
occ:0.33
 W15 A:HFW201 0.0 15.4 0.3
O52 A:HFW201 1.7 13.0 0.3
O46 A:HFW201 1.9 16.0 0.3
O53 A:HFW201 1.9 15.3 0.3
O57 A:HFW201 1.9 15.4 0.3
O51 A:HFW201 1.9 15.2 0.3
O45 A:HFW201 2.4 13.9 0.3
W16 A:HFW201 3.4 13.0 0.3
W17 A:HFW201 3.4 14.4 0.3
P2 A:HFW201 3.5 10.3 0.3
O55 A:HFW201 3.6 14.2 0.3
O A:HOH355 3.6 28.8 1.0
O30 A:HFW201 3.6 10.9 0.3
W9 A:HFW201 3.7 12.7 0.3
W14 A:HFW201 3.7 13.9 0.3
O47 A:HFW201 3.7 14.9 0.3
O50 A:HFW201 3.8 11.6 0.3
O42 A:HFW201 3.8 11.2 0.3
O44 A:HFW201 3.8 12.0 0.3
O32 A:HFW201 4.4 10.3 0.3
O40 A:HFW201 4.4 13.0 0.3
O41 A:HFW201 4.5 12.5 0.3
O31 A:HFW201 4.5 12.1 0.3
O54 A:HFW201 4.6 13.8 0.3
O56 A:HFW201 4.7 14.1 0.3
O49 A:HFW201 4.8 13.4 0.3
O48 A:HFW201 4.8 13.5 0.3
O43 A:HFW201 4.8 12.1 0.3

Tungsten binding site 8 out of 17 in 5fhw

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Tungsten binding site 8 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 8 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:13.0
occ:0.33
 W16 A:HFW201 0.0 13.0 0.3
O54 A:HFW201 1.7 13.8 0.3
O55 A:HFW201 1.9 14.2 0.3
O47 A:HFW201 1.9 14.9 0.3
O48 A:HFW201 1.9 13.5 0.3
O53 A:HFW201 1.9 15.3 0.3
O45 A:HFW201 2.4 13.9 0.3
W15 A:HFW201 3.4 15.4 0.3
W17 A:HFW201 3.4 14.4 0.3
P2 A:HFW201 3.5 10.3 0.3
O57 A:HFW201 3.5 15.4 0.3
O49 A:HFW201 3.7 13.4 0.3
O A:HOH307 3.7 24.4 0.7
O34 A:HFW201 3.7 12.4 0.3
W11 A:HFW201 3.7 11.8 0.3
W10 A:HFW201 3.8 11.7 0.3
O42 A:HFW201 3.8 11.2 0.3
O46 A:HFW201 3.8 16.0 0.3
O43 A:HFW201 3.8 12.1 0.3
O36 A:HFW201 4.4 13.0 0.3
O33 A:HFW201 4.4 13.7 0.3
O32 A:HFW201 4.4 10.3 0.3
O35 A:HFW201 4.5 15.2 0.3
O52 A:HFW201 4.7 13.0 0.3
O56 A:HFW201 4.7 14.1 0.3
O50 A:HFW201 4.7 11.6 0.3
O44 A:HFW201 4.8 12.0 0.3
O51 A:HFW201 4.8 15.2 0.3
W12 A:HFW201 5.0 12.8 0.3

Tungsten binding site 9 out of 17 in 5fhw

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Tungsten binding site 9 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 9 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:14.4
occ:0.33
 W17 A:HFW201 0.0 14.4 0.3
O56 A:HFW201 1.7 14.1 0.3
O50 A:HFW201 1.8 11.6 0.3
O49 A:HFW201 1.9 13.4 0.3
O55 A:HFW201 2.0 14.2 0.3
O57 A:HFW201 2.0 15.4 0.3
O45 A:HFW201 2.4 13.9 0.3
W16 A:HFW201 3.4 13.0 0.3
W15 A:HFW201 3.4 15.4 0.3
O38 A:HFW201 3.5 12.1 0.3
P2 A:HFW201 3.5 10.3 0.3
O53 A:HFW201 3.6 15.3 0.3
W13 A:HFW201 3.7 13.1 0.3
W12 A:HFW201 3.7 12.8 0.3
O48 A:HFW201 3.8 13.5 0.3
O51 A:HFW201 3.8 15.2 0.3
O44 A:HFW201 3.8 12.0 0.3
O43 A:HFW201 3.8 12.1 0.3
O39 A:HFW201 4.4 15.2 0.3
O40 A:HFW201 4.4 13.0 0.3
O36 A:HFW201 4.4 13.0 0.3
O37 A:HFW201 4.5 13.2 0.3
O54 A:HFW201 4.6 13.8 0.3
O52 A:HFW201 4.7 13.0 0.3
O47 A:HFW201 4.8 14.9 0.3
O42 A:HFW201 4.8 11.2 0.3
O46 A:HFW201 4.8 16.0 0.3

Tungsten binding site 10 out of 17 in 5fhw

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Tungsten binding site 10 out of 17 in the Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate


Mono view


Stereo pair view

A full contact list of Tungsten with other atoms in the W binding site number 10 of Hen Egg-White Lysozyme (Hewl) Complexed with Hf(IV)-Substituted Wells Dawson-Type Polyoxometalate within 5.0Å range:
probe atom residue distance (Å) B Occ
A:W201

b:10.9
occ:0.33
 W2 A:HFW201 0.0 10.9 0.3
O2L A:HFW201 1.7 15.3 0.3
O3 A:HFW201 1.7 11.7 0.3
O6 A:HFW201 1.9 10.4 0.3
O2 A:HFW201 1.9 12.4 0.3
O5 A:HFW201 2.0 14.7 0.3
O8 A:HFW201 2.3 14.1 0.3
W1 A:HFW201 3.4 23.3 0.3
HF1 A:HFW201 3.4 13.3 0.3
P1 A:HFW201 3.5 9.8 0.3
O1L A:HFW201 3.6 17.9 0.3
O3L A:HFW201 3.7 10.7 0.3
W4 A:HFW201 3.7 10.0 0.3
W5 A:HFW201 3.8 11.7 0.3
O13 A:HFW201 3.8 13.7 0.3
O4 A:HFW201 3.8 14.2 0.3
O21 A:HFW201 3.8 11.0 0.3
O22 A:HFW201 3.8 12.0 0.3
O A:HOH358 4.0 16.1 1.0
O A:HOH340 4.1 15.6 1.0
O11 A:HFW201 4.4 10.8 0.3
O14 A:HFW201 4.5 12.1 0.3
CB A:ARG45 4.5 13.2 1.0
O12 A:HFW201 4.5 17.7 0.3
O A:HOH380 4.5 22.8 1.0
O15 A:HFW201 4.6 12.4 0.3
O1 A:HFW201 4.7 13.4 0.3
O23 A:HFW201 4.8 11.6 0.3
O7 A:HFW201 4.8 13.8 0.3
CG A:ARG45 4.8 14.9 1.0
O4L A:HFW201 4.9 17.2 0.3
W3 A:HFW201 4.9 10.5 0.3

Reference:

L.Vandebroek, E.De Zitter, L.Van Meervelt, T.N.Parac-Vogt. Structural Characterization of the Complex Between Hen Egg- White Lysozyme and Hfiv-Substituted Wells Dawson Polyoxometalate As Artificial Protease To Be Published.
Page generated: Sat Oct 12 04:49:10 2024

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