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Calcium in PDB 8tal: TMEM16F, with Calcium and PIP2, No Inhibitor, CL1

Calcium Binding Sites:

The binding sites of Calcium atom in the TMEM16F, with Calcium and PIP2, No Inhibitor, CL1 (pdb code 8tal). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 3 binding sites of Calcium where determined in the TMEM16F, with Calcium and PIP2, No Inhibitor, CL1, PDB code: 8tal:
Jump to Calcium binding site number: 1; 2; 3;

Calcium binding site 1 out of 3 in 8tal

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Calcium binding site 1 out of 3 in the TMEM16F, with Calcium and PIP2, No Inhibitor, CL1


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of TMEM16F, with Calcium and PIP2, No Inhibitor, CL1 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca904

b:161.5
occ:1.00
OE2 A:GLU699 2.2 61.9 1.0
OE1 A:GLU667 2.5 61.2 1.0
OE2 A:GLU667 2.5 61.2 1.0
HB3 A:ASN621 2.7 69.6 1.0
HB2 A:ASN621 2.8 69.6 1.0
CD A:GLU667 2.8 61.2 1.0
OE1 A:GLU670 2.9 57.3 1.0
OD1 A:ASP703 3.1 65.6 1.0
CB A:ASN621 3.1 69.6 1.0
HZ3 A:LYS706 3.2 67.8 1.0
HD21 A:ASN621 3.4 69.6 1.0
CD A:GLU699 3.4 61.9 1.0
CG A:ASN621 3.7 69.6 1.0
ND2 A:ASN621 3.8 69.6 1.0
CD A:GLU670 4.0 57.3 1.0
OE1 A:GLU699 4.0 61.9 1.0
NZ A:LYS706 4.0 67.8 1.0
CG A:ASP703 4.0 65.6 1.0
OD2 A:ASP703 4.2 65.6 1.0
HZ2 A:LYS706 4.3 67.8 1.0
HZ1 A:LYS706 4.3 67.8 1.0
HA A:GLU667 4.3 61.2 1.0
OE2 A:GLU670 4.3 57.3 1.0
CG A:GLU667 4.3 61.2 1.0
HG3 A:GLU699 4.4 61.9 1.0
CA A:ASN621 4.4 69.6 1.0
OD1 A:ASN621 4.5 69.6 1.0
CG A:GLU699 4.5 61.9 1.0
HA A:ASN621 4.5 69.6 1.0
HG2 A:GLU667 4.7 61.2 1.0
H A:ASN621 4.7 69.6 1.0
HD3 A:LYS706 4.7 67.8 1.0
HD22 A:ASN621 4.7 69.6 1.0
HG2 A:GLU699 4.8 61.9 1.0
HG12 A:VAL702 4.8 67.5 1.0
HG3 A:GLU667 4.8 61.2 1.0
HB3 A:GLU667 4.9 61.2 1.0
HB3 A:GLU670 4.9 57.3 1.0

Calcium binding site 2 out of 3 in 8tal

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Calcium binding site 2 out of 3 in the TMEM16F, with Calcium and PIP2, No Inhibitor, CL1


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of TMEM16F, with Calcium and PIP2, No Inhibitor, CL1 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca904

b:157.5
occ:1.00
OE1 B:GLU667 2.1 58.4 1.0
OE2 B:GLU624 2.2 65.0 1.0
OE1 B:GLU624 2.3 65.0 1.0
OE2 B:GLU670 2.3 59.3 1.0
OD1 B:ASP703 2.3 56.4 1.0
OE2 B:GLU699 2.4 60.3 1.0
CD B:GLU624 2.5 65.0 1.0
CG B:ASP703 3.1 56.4 1.0
OD2 B:ASP703 3.1 56.4 1.0
CD B:GLU667 3.2 58.4 1.0
CD B:GLU699 3.5 60.3 1.0
HG3 B:GLU699 3.5 60.3 1.0
CD B:GLU670 3.5 59.3 1.0
CA B:CA905 3.6 160.3 1.0
OE2 B:GLU667 3.7 58.4 1.0
CG B:GLU699 3.9 60.3 1.0
HG2 B:GLU699 4.0 60.3 1.0
CG B:GLU624 4.0 65.0 1.0
OE1 B:GLU670 4.1 59.3 1.0
HZ2 B:LYS706 4.1 58.6 1.0
HD3 B:LYS706 4.2 58.6 1.0
HA B:GLU667 4.2 58.4 1.0
HG12 B:VAL702 4.3 58.4 1.0
HG3 B:GLU624 4.4 65.0 1.0
CG B:GLU667 4.5 58.4 1.0
HB3 B:GLU667 4.5 58.4 1.0
HG2 B:GLU624 4.5 65.0 1.0
HB3 B:GLU624 4.5 65.0 1.0
HG2 B:GLU670 4.5 59.3 1.0
CB B:ASP703 4.5 56.4 1.0
OE1 B:GLU699 4.6 60.3 1.0
HH B:TYR299 4.6 57.3 1.0
HG3 B:GLU667 4.6 58.4 1.0
HA B:ASP703 4.6 56.4 1.0
HZ1 B:LYS706 4.6 58.6 1.0
CG B:GLU670 4.7 59.3 1.0
HD2 B:LYS706 4.7 58.6 1.0
CB B:GLU624 4.8 65.0 1.0
NZ B:LYS706 4.8 58.6 1.0
HB2 B:GLU624 4.8 65.0 1.0
CB B:GLU667 4.9 58.4 1.0
CD B:LYS706 4.9 58.6 1.0
OH B:TYR299 4.9 57.3 1.0
HB3 B:ASP703 5.0 56.4 1.0

Calcium binding site 3 out of 3 in 8tal

Go back to Calcium Binding Sites List in 8tal
Calcium binding site 3 out of 3 in the TMEM16F, with Calcium and PIP2, No Inhibitor, CL1


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 3 of TMEM16F, with Calcium and PIP2, No Inhibitor, CL1 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca905

b:160.3
occ:1.00
OE2 B:GLU699 2.0 60.3 1.0
OE1 B:GLU670 2.4 59.3 1.0
OD1 B:ASN621 2.4 65.2 1.0
OE2 B:GLU624 2.7 65.0 1.0
CD B:GLU699 2.7 60.3 1.0
OE1 B:GLU699 2.8 60.3 1.0
CD B:GLU670 3.1 59.3 1.0
OE2 B:GLU670 3.1 59.3 1.0
HB3 B:ASN620 3.4 67.1 1.0
HA B:ASN621 3.4 65.2 1.0
CG B:ASN621 3.5 65.2 1.0
ND2 B:ASN620 3.6 67.1 1.0
CG B:ASN620 3.6 67.1 1.0
CA B:CA904 3.6 157.5 1.0
HD21 B:ASN620 3.7 67.1 1.0
CD B:GLU624 3.8 65.0 1.0
HD22 B:ASN620 3.8 67.1 1.0
N B:ASN621 3.9 65.2 1.0
CB B:ASN620 4.0 67.1 1.0
OD1 B:ASN620 4.0 67.1 1.0
CA B:ASN621 4.0 65.2 1.0
C B:ASN620 4.0 67.1 1.0
H B:ASN621 4.1 65.2 1.0
HG3 B:GLU624 4.2 65.0 1.0
CG B:GLU699 4.2 60.3 1.0
O B:ASN620 4.3 67.1 1.0
CB B:ASN621 4.4 65.2 1.0
HD22 B:ASN621 4.4 65.2 1.0
ND2 B:ASN621 4.5 65.2 1.0
HG2 B:GLU699 4.5 60.3 1.0
HG3 B:GLU699 4.5 60.3 1.0
CG B:GLU624 4.6 65.0 1.0
CG B:GLU670 4.6 59.3 1.0
HB2 B:GLU624 4.6 65.0 1.0
CA B:ASN620 4.7 67.1 1.0
OE1 B:GLU624 4.7 65.0 1.0
HB2 B:ASN620 4.7 67.1 1.0
HB2 B:GLU670 4.8 59.3 1.0
O B:ALA617 4.8 66.4 1.0
HG3 B:GLU670 4.9 59.3 1.0
HB2 B:ASN621 4.9 65.2 1.0
OD1 B:ASN695 5.0 63.5 1.0

Reference:

S.Feng, C.Puchades, J.Ko, H.Wu, Y.Chen, E.E.Figueroa, S.Gu, T.W.Han, B.Ho, T.Cheng, J.Li, B.Shoichet, Y.N.Jan, Y.Cheng, L.Y.Jan. Identification of A Drug Binding Pocket in TMEM16F Calcium-Activated Ion Channel and Lipid Scramblase. Nat Commun V. 14 4874 2023.
ISSN: ESSN 2041-1723
PubMed: 37573365
DOI: 10.1038/S41467-023-40410-X
Page generated: Fri Jul 19 12:01:22 2024

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