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Magnesium in PDB 6wwl: KIF14[391-755] Dimer Two-Heads-Bound State - Amp-Pnp in Complex with A Microtubule

Magnesium Binding Sites:

The binding sites of Magnesium atom in the KIF14[391-755] Dimer Two-Heads-Bound State - Amp-Pnp in Complex with A Microtubule (pdb code 6wwl). This binding sites where shown within 5.0 Angstroms radius around Magnesium atom.
In total 3 binding sites of Magnesium where determined in the KIF14[391-755] Dimer Two-Heads-Bound State - Amp-Pnp in Complex with A Microtubule, PDB code: 6wwl:
Jump to Magnesium binding site number: 1; 2; 3;

Magnesium binding site 1 out of 3 in 6wwl

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Magnesium binding site 1 out of 3 in the KIF14[391-755] Dimer Two-Heads-Bound State - Amp-Pnp in Complex with A Microtubule


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 1 of KIF14[391-755] Dimer Two-Heads-Bound State - Amp-Pnp in Complex with A Microtubule within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Mg502

b:67.0
occ:1.00
O1G A:GTP501 2.0 66.0 1.0
O1B A:GTP501 2.0 66.0 1.0
OE1 A:GLU71 2.1 71.2 1.0
OD2 A:ASP98 2.1 70.5 1.0
CG A:ASP98 3.0 70.5 1.0
PG A:GTP501 3.1 66.0 1.0
CD A:GLU71 3.1 71.2 1.0
PB A:GTP501 3.1 66.0 1.0
O3B A:GTP501 3.2 66.0 1.0
OD1 A:ASP98 3.3 70.5 1.0
CB A:GLU71 3.7 71.2 1.0
O2G A:GTP501 3.8 66.0 1.0
OE2 A:GLU71 3.9 71.2 1.0
CG A:GLU71 4.0 71.2 1.0
NZ B:LYS252 4.0 66.4 1.0
O3A A:GTP501 4.1 66.0 1.0
O2B A:GTP501 4.3 66.0 1.0
OD1 A:ASP69 4.3 68.9 1.0
OD2 A:ASP69 4.3 68.9 1.0
O3G A:GTP501 4.3 66.0 1.0
CB A:ASP98 4.4 70.5 1.0
OE1 A:GLN11 4.6 66.6 1.0
O1A A:GTP501 4.6 66.0 1.0
CG A:ASP69 4.7 68.9 1.0
CB A:GLN11 4.7 66.6 1.0
PA A:GTP501 4.9 66.0 1.0
OG1 A:THR145 5.0 67.5 1.0

Magnesium binding site 2 out of 3 in 6wwl

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Magnesium binding site 2 out of 3 in the KIF14[391-755] Dimer Two-Heads-Bound State - Amp-Pnp in Complex with A Microtubule


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 2 of KIF14[391-755] Dimer Two-Heads-Bound State - Amp-Pnp in Complex with A Microtubule within 5.0Å range:
probe atom residue distance (Å) B Occ
K:Mg801

b:105.4
occ:1.00
O1G K:ANP802 2.0 104.9 1.0
O2B K:ANP802 2.0 104.9 1.0
OG K:SER489 2.1 101.2 1.0
O3G K:ANP802 2.2 104.9 1.0
PG K:ANP802 2.5 104.9 1.0
PB K:ANP802 3.1 104.9 1.0
OG K:SER603 3.1 99.3 1.0
CB K:SER603 3.3 99.3 1.0
CB K:SER489 3.3 101.2 1.0
N3B K:ANP802 3.3 104.9 1.0
O1B K:ANP802 3.7 104.9 1.0
N K:SER603 3.8 99.3 1.0
O2G K:ANP802 3.9 104.9 1.0
N K:SER489 3.9 101.2 1.0
O2A K:ANP802 4.1 104.9 1.0
CA K:SER603 4.1 99.3 1.0
OD1 K:ASP638 4.2 95.0 1.0
O K:LEU639 4.2 91.1 1.0
CA K:SER489 4.2 101.2 1.0
OD2 K:ASP638 4.3 95.0 1.0
O3A K:ANP802 4.4 104.9 1.0
CG K:ASP638 4.6 95.0 1.0
PA K:ANP802 4.7 104.9 1.0
CB K:LYS488 4.8 100.9 1.0
CE K:LYS488 4.8 100.9 1.0
O1A K:ANP802 4.8 104.9 1.0
NZ K:LYS488 4.8 100.9 1.0
C K:SER602 4.8 104.0 1.0
O K:SER603 4.9 99.3 1.0
C K:LYS488 4.9 100.9 1.0
CA K:SER602 5.0 104.0 1.0

Magnesium binding site 3 out of 3 in 6wwl

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Magnesium binding site 3 out of 3 in the KIF14[391-755] Dimer Two-Heads-Bound State - Amp-Pnp in Complex with A Microtubule


Mono view


Stereo pair view

A full contact list of Magnesium with other atoms in the Mg binding site number 3 of KIF14[391-755] Dimer Two-Heads-Bound State - Amp-Pnp in Complex with A Microtubule within 5.0Å range:
probe atom residue distance (Å) B Occ
E:Mg502

b:78.3
occ:1.00
O1G E:GTP501 2.0 91.5 1.0
OE1 E:GLU71 2.3 74.8 1.0
CD E:GLU71 2.3 74.8 1.0
OE2 E:GLU71 2.4 74.8 1.0
OD2 E:ASP98 2.5 75.3 1.0
PG E:GTP501 3.2 91.5 1.0
O3G E:GTP501 3.4 91.5 1.0
CG E:GLU71 3.4 74.8 1.0
CG E:ASP98 3.6 75.3 1.0
O1B E:GTP501 3.8 91.5 1.0
O2G E:GTP501 4.0 91.5 1.0
OD1 E:ASP98 4.1 75.3 1.0
CB E:GLU71 4.2 74.8 1.0
OE1 E:GLN11 4.3 72.9 1.0
O3B E:GTP501 4.3 91.5 1.0
CB E:GLN11 4.4 72.9 1.0
OD1 E:ASP69 4.5 71.3 1.0
NZ I:LYS252 4.6 70.9 1.0
CD E:GLN11 4.7 72.9 1.0
PB E:GTP501 4.7 91.5 1.0
CB E:ASP98 4.8 75.3 1.0
O1A E:GTP501 4.9 91.5 1.0

Reference:

M.P.M.H.Benoit, A.B.Asenjo, M.Paydar, S.Dhakal, B.Kwok, H.Sosa. Structural Basis of Mechano-Chemical Coupling By the Mitotic Kinesin KIF14 To Be Published.
Page generated: Tue Oct 1 23:18:41 2024

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