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Magnesium in PDB 8y0l: Beta-Glucosidase From Thermoascus Aurantiacus

Enzymatic activity of Beta-Glucosidase From Thermoascus Aurantiacus

All present enzymatic activity of Beta-Glucosidase From Thermoascus Aurantiacus:
3.2.1.21;

Protein crystallography data

The structure of Beta-Glucosidase From Thermoascus Aurantiacus, PDB code: 8y0l was solved by C.Matsuzaki, T.Katayama, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 37.13 / 2.15
Space group P 21 21 21
Cell size a, b, c (Å), α, β, γ (°) 138.945, 149.752, 175.529, 90, 90, 90
R / Rfree (%) 16.8 / 20.1

Magnesium Binding Sites:

Pages:

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

Binding sites:

The binding sites of Magnesium atom in the Beta-Glucosidase From Thermoascus Aurantiacus (pdb code 8y0l). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 12 binding sites of Magnesium where determined in the Beta-Glucosidase From Thermoascus Aurantiacus, PDB code: 8y0l:
Jump to Magnesium binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Magnesium binding site 1 out of 12 in 8y0l

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Magnesium binding site 1 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg901

b:21.6
occ:1.00
O A:HOH1074 2.0 16.5 1.0
O D:HOH1584 2.0 20.6 1.0
O A:HOH1047 2.0 18.7 1.0
O A:HOH1148 2.1 14.9 1.0
O A:HOH1286 2.1 18.6 1.0
O A:HOH1270 2.2 19.7 1.0
OD2 A:ASP357 3.9 16.4 1.0
NZ D:LYS620 4.0 23.6 1.0
O A:GLU72 4.0 20.8 1.0
OE2 A:GLU367 4.1 27.0 1.0
O A:HOH1651 4.2 35.4 1.0
OE1 A:GLU367 4.4 26.5 1.0
OD1 A:ASP357 4.4 15.8 1.0
CD1 A:TRP359 4.5 17.2 1.0
CG A:ASP357 4.6 15.8 1.0
CD A:GLU367 4.7 27.0 1.0
CE D:LYS620 4.7 23.5 1.0
O A:HOH1767 4.7 27.2 1.0
C A:GLU72 4.8 20.8 1.0
O A:MET70 4.8 22.6 1.0

Magnesium binding site 2 out of 12 in 8y0l

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Magnesium binding site 2 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg902

b:15.1
occ:1.00
O A:HOH1232 2.1 14.8 1.0
O A:HOH1172 2.1 11.9 1.0
O A:HOH1226 2.1 14.1 1.0
OD1 A:ASP273 2.1 12.9 1.0
OD2 A:ASP36 2.2 19.6 1.0
O A:HOH1419 2.2 13.1 1.0
CG A:ASP36 3.0 19.6 1.0
CG A:ASP273 3.1 12.9 1.0
OD1 A:ASP36 3.3 19.5 1.0
OD2 A:ASP273 3.5 13.1 1.0
NE2 A:GLN275 4.0 13.5 1.0
O A:HOH1136 4.1 11.3 1.0
O A:HOH1408 4.1 15.2 1.0
O A:HOH1038 4.1 9.6 1.0
O A:LYS269 4.2 12.8 1.0
O A:HOH1683 4.3 19.0 1.0
CB A:ASP273 4.3 12.9 1.0
O A:TRP34 4.4 15.4 1.0
CB A:ASP36 4.4 19.5 1.0
O A:HOH1586 4.7 20.9 1.0
O A:HOH1071 4.7 18.6 1.0
CA A:ASP273 4.7 12.8 1.0
N A:ASP36 4.9 18.6 1.0

Magnesium binding site 3 out of 12 in 8y0l

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Magnesium binding site 3 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 3 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg903

b:39.7
occ:1.00
O A:HOH1188 2.1 28.6 1.0
O A:HOH1503 2.2 44.9 1.0
OE1 A:GLU131 2.3 13.2 1.0
NE2 A:HIS388 2.7 13.7 1.0
CD A:GLU131 3.2 13.1 1.0
CD2 A:HIS388 3.3 13.7 1.0
O A:HOH1588 3.4 43.7 1.0
O A:HOH1697 3.5 40.6 1.0
OE2 A:GLU131 3.6 13.4 1.0
OD1 A:ASP387 3.6 17.7 1.0
CE1 A:HIS388 3.9 13.7 1.0
CB A:ALA386 4.5 15.6 1.0
CG A:HIS388 4.5 13.7 1.0
CG A:GLU131 4.6 12.9 1.0
O A:HOH1205 4.8 42.0 1.0
ND1 A:HIS388 4.8 13.7 1.0
CG A:ASP387 4.8 17.4 1.0
O A:HOH1571 4.8 29.9 1.0
CB A:GLU131 4.9 12.7 1.0

Magnesium binding site 4 out of 12 in 8y0l

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Magnesium binding site 4 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 4 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg901

b:17.9
occ:1.00
O B:HOH1283 2.0 16.4 1.0
OD2 B:ASP36 2.0 19.0 1.0
O B:HOH1336 2.1 13.1 1.0
O B:HOH1242 2.1 10.2 1.0
O B:HOH1147 2.1 13.8 1.0
OD1 B:ASP273 2.1 13.9 1.0
CG B:ASP36 3.0 19.1 1.0
CG B:ASP273 3.1 13.9 1.0
OD1 B:ASP36 3.3 19.1 1.0
OD2 B:ASP273 3.5 14.0 1.0
NE2 B:GLN275 3.8 14.5 1.0
O B:HOH1209 4.0 17.1 1.0
O B:HOH1403 4.2 21.1 1.0
O B:HOH1036 4.2 10.3 1.0
O B:HOH1643 4.2 14.8 1.0
O B:LYS269 4.3 14.9 1.0
CB B:ASP36 4.3 19.1 1.0
O B:HOH1533 4.4 17.8 1.0
O B:TRP34 4.4 16.7 1.0
CB B:ASP273 4.4 13.9 1.0
O B:HOH1420 4.7 25.4 1.0
CA B:ASP273 4.8 13.9 1.0
N B:ASP36 4.8 18.4 1.0
O B:HOH1230 4.8 43.6 1.0
CD B:GLN275 5.0 14.5 1.0

Magnesium binding site 5 out of 12 in 8y0l

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Magnesium binding site 5 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 5 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg902

b:29.3
occ:1.00
O B:HOH1249 2.0 30.1 1.0
OE1 B:GLU131 2.1 13.6 1.0
O B:HOH1430 2.5 40.0 1.0
NE2 B:HIS388 2.5 14.2 1.0
CD2 B:HIS388 3.1 14.3 1.0
CD B:GLU131 3.1 13.3 1.0
OE2 B:GLU131 3.5 13.5 1.0
CE1 B:HIS388 3.6 14.2 1.0
OD1 B:ASP387 3.8 19.1 1.0
NZ B:LYS127 4.1 16.0 1.0
CG B:HIS388 4.4 14.3 1.0
CG B:GLU131 4.5 12.9 1.0
O B:HOH1525 4.5 27.8 1.0
ND1 B:HIS388 4.6 14.3 1.0
CB B:GLU131 4.7 12.7 1.0
CA B:ALA128 4.7 12.5 1.0
CB B:ALA386 4.8 15.9 1.0
CB B:ALA128 4.8 12.6 1.0
CG B:ASP387 4.9 18.4 1.0

Magnesium binding site 6 out of 12 in 8y0l

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Magnesium binding site 6 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 6 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Mg903

b:29.2
occ:1.00
O B:HOH1244 1.9 24.4 1.0
O B:HOH1288 2.0 20.6 1.0
O C:HOH1573 2.0 30.6 1.0
O B:HOH1021 2.1 27.0 1.0
O B:HOH1171 2.1 25.0 1.0
O B:HOH1408 2.1 31.9 1.0
O B:GLU72 3.8 25.5 1.0
OD2 B:ASP357 3.9 17.0 1.0
OE2 B:GLU367 4.1 41.2 1.0
NZ C:LYS620 4.1 26.1 1.0
O B:HOH1578 4.2 38.4 1.0
OE1 B:GLU367 4.3 41.8 1.0
OD1 B:ASP357 4.4 16.1 1.0
CD1 B:TRP359 4.4 17.8 1.0
CE C:LYS620 4.5 25.5 1.0
OD2 C:ASP212 4.5 22.8 1.0
C B:GLU72 4.5 25.3 1.0
CG B:ASP357 4.6 16.2 1.0
CD B:GLU367 4.7 40.3 1.0
O B:MET70 4.7 27.9 1.0
O B:GLN71 4.7 28.8 1.0
O C:HOH1537 4.8 39.3 1.0
CA B:GLU72 4.9 26.3 1.0
OD1 C:ASP212 5.0 22.1 1.0

Magnesium binding site 7 out of 12 in 8y0l

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Magnesium binding site 7 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 7 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Mg901

b:23.1
occ:1.00
O C:HOH1250 2.0 20.1 1.0
O C:HOH1379 2.0 20.1 1.0
O C:HOH1399 2.1 19.2 1.0
OD1 C:ASP273 2.1 17.6 1.0
O C:HOH1245 2.2 17.8 1.0
OD2 C:ASP36 2.2 30.0 1.0
CG C:ASP273 3.1 17.6 1.0
CG C:ASP36 3.4 29.8 1.0
OD2 C:ASP273 3.6 18.3 1.0
NE2 C:GLN275 3.8 17.2 1.0
O C:HOH1034 4.1 19.5 1.0
O C:HOH1207 4.1 34.9 1.0
O C:HOH1025 4.1 14.1 1.0
CB C:ASP36 4.2 29.1 1.0
O C:LYS269 4.3 18.2 1.0
OD1 C:ASP36 4.3 30.3 1.0
CB C:ASP273 4.4 17.4 1.0
O C:HOH1684 4.5 29.2 1.0
O C:TRP34 4.5 23.7 1.0
CA C:ASP273 4.7 17.2 1.0
N C:ASP36 4.7 27.3 1.0
O C:HOH1600 4.7 40.1 1.0
O C:HOH1003 4.7 23.8 1.0

Magnesium binding site 8 out of 12 in 8y0l

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Magnesium binding site 8 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 8 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Mg902

b:36.7
occ:1.00
O C:HOH1464 2.0 34.1 1.0
O C:HOH1485 2.0 35.1 1.0
OE1 C:GLU131 2.0 15.6 1.0
NE2 C:HIS388 2.6 15.0 1.0
CD C:GLU131 3.1 15.4 1.0
CD2 C:HIS388 3.1 14.9 1.0
OE2 C:GLU131 3.4 15.6 1.0
O C:HOH1572 3.6 29.5 1.0
CE1 C:HIS388 3.8 15.0 1.0
OD1 C:ASP387 3.9 18.4 1.0
O C:HOH1394 4.4 33.2 1.0
CG C:HIS388 4.4 14.8 1.0
CG C:GLU131 4.4 15.1 1.0
CA C:ALA128 4.6 14.2 1.0
ND1 C:HIS388 4.7 15.0 1.0
CB C:GLU131 4.7 14.8 1.0
CB C:ALA128 4.8 14.1 1.0

Magnesium binding site 9 out of 12 in 8y0l

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Magnesium binding site 9 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 9 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Mg903

b:25.0
occ:1.00
O C:HOH1019 1.9 18.6 1.0
O C:HOH1178 2.0 18.9 1.0
O B:HOH1611 2.0 19.1 1.0
O C:HOH1069 2.1 16.7 1.0
O C:HOH1124 2.1 24.2 1.0
O C:HOH1165 2.2 18.1 1.0
O C:GLU72 3.9 22.8 1.0
OE2 C:GLU367 4.0 26.7 1.0
OD2 C:ASP357 4.0 17.9 1.0
NZ B:LYS620 4.0 20.1 1.0
O C:HOH1630 4.2 36.9 1.0
OE1 C:GLU367 4.3 26.5 1.0
OD1 C:ASP357 4.4 17.4 1.0
O C:HOH1695 4.5 25.9 1.0
CD1 C:TRP359 4.5 16.3 1.0
CD C:GLU367 4.5 26.6 1.0
CE B:LYS620 4.6 19.9 1.0
CG C:ASP357 4.6 17.4 1.0
C C:GLU72 4.7 22.8 1.0
O C:HOH1306 4.7 42.1 1.0
O C:MET70 4.8 25.0 1.0
O B:HOH1628 4.9 32.2 1.0
O C:GLN71 4.9 25.3 1.0

Magnesium binding site 10 out of 12 in 8y0l

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Magnesium binding site 10 out of 12 in the Beta-Glucosidase From Thermoascus Aurantiacus


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 10 of Beta-Glucosidase From Thermoascus Aurantiacus within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Mg901

b:26.4
occ:1.00
O D:HOH1493 2.0 27.2 1.0
O D:HOH1428 2.1 17.7 1.0
OD2 D:ASP36 2.1 27.1 1.0
O D:HOH1352 2.1 22.7 1.0
OD1 D:ASP273 2.1 18.8 1.0
O D:HOH1319 2.2 26.8 1.0
CG D:ASP273 3.1 18.7 1.0
CG D:ASP36 3.3 27.6 1.0
OD2 D:ASP273 3.6 19.0 1.0
NE2 D:GLN275 3.9 17.8 1.0
CB D:ASP36 4.0 27.4 1.0
O D:HOH1046 4.1 17.9 1.0
OD1 D:ASP36 4.2 27.6 1.0
O D:HOH1016 4.2 17.0 1.0
O D:HOH1099 4.2 27.5 1.0
O D:HOH1676 4.3 38.6 1.0
CB D:ASP273 4.4 18.4 1.0
O D:LYS269 4.4 19.0 1.0
O D:TRP34 4.5 22.8 1.0
N D:ASP36 4.7 26.5 1.0
O D:HOH1005 4.7 22.8 1.0
CA D:ASP273 4.7 18.2 1.0

Reference:

C.Matsuzaki, M.Hidaka, Y.Nakashima, Y.Honda, T.Koyanagi, K.Ishikawa, T.Katoh, H.Kumagai, T.Katayama. Structure of Beta-Glucosidase From Thermoascus Aurantiacus To Be Published.
Page generated: Fri Aug 15 21:17:45 2025

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