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Calcium in PDB 8d40: Crystal Structure of Human CELSR1 EC1-4

Protein crystallography data

The structure of Crystal Structure of Human CELSR1 EC1-4, PDB code: 8d40 was solved by E.Tamilselvan, M.Sotomayor, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 47.24 / 3.55
Space group C 1 2 1
Cell size a, b, c (Å), α, β, γ (°) 305.653, 90.356, 94.949, 90, 96.17, 90
R / Rfree (%) 21.6 / 25.2

Other elements in 8d40:

The structure of Crystal Structure of Human CELSR1 EC1-4 also contains other interesting chemical elements:

Sodium (Na) 3 atoms

Calcium Binding Sites:

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 15;

Binding sites:

The binding sites of Calcium atom in the Crystal Structure of Human CELSR1 EC1-4 (pdb code 8d40). This binding sites where shown within 5.0 Angstroms radius around Calcium atom.
In total 15 binding sites of Calcium where determined in the Crystal Structure of Human CELSR1 EC1-4, PDB code: 8d40:
Jump to Calcium binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Calcium binding site 1 out of 15 in 8d40

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Calcium binding site 1 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 1 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca502

b:125.9
occ:1.00
OD1 A:ASP110 1.8 137.9 1.0
OE2 A:GLU21 2.1 166.2 1.0
OE1 A:GLU21 2.2 141.5 1.0
OE2 A:GLU79 2.3 115.0 1.0
OD1 A:ASP146 2.4 118.0 1.0
CD A:GLU21 2.4 142.6 1.0
OD1 A:ASP113 2.7 153.1 1.0
CG A:ASP110 3.0 126.1 1.0
CG A:ASP113 3.1 136.1 1.0
CD A:GLU79 3.2 119.3 1.0
OD2 A:ASP113 3.3 133.5 1.0
OE1 A:GLU79 3.4 124.9 1.0
CG A:ASP146 3.6 117.8 1.0
N A:THR111 3.7 123.8 1.0
NH2 A:ARG78 3.8 144.2 1.0
OD2 A:ASP110 3.8 134.0 1.0
N A:ASP113 3.9 117.8 1.0
CG A:GLU21 3.9 131.8 1.0
CB A:ASP110 4.1 117.5 1.0
CB A:ASP113 4.1 128.8 1.0
N A:ASN112 4.1 128.9 1.0
CA A:ASP110 4.2 119.8 1.0
OG1 A:THR111 4.2 138.9 1.0
OD2 A:ASP146 4.3 116.8 1.0
NA A:NA501 4.4 111.7 1.0
C A:ASP110 4.5 120.4 1.0
CG A:GLU79 4.5 122.3 1.0
CB A:ASP146 4.5 117.1 1.0
C A:THR111 4.6 142.4 1.0
NE A:ARG78 4.6 146.0 1.0
CA A:ASP113 4.6 127.2 1.0
CZ A:ARG78 4.6 142.4 1.0
CA A:THR111 4.6 132.2 1.0
CA A:ASN112 4.7 121.9 1.0
CB A:GLU21 4.7 139.8 1.0
CA A:ASP146 4.7 115.4 1.0
C A:ASN112 4.8 118.4 1.0
O A:ARG145 4.9 136.7 1.0

Calcium binding site 2 out of 15 in 8d40

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Calcium binding site 2 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 2 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca503

b:121.8
occ:1.00
OD1 A:ASN112 1.8 152.9 1.0
OD2 A:ASP144 2.1 137.0 1.0
O A:ASN150 2.3 124.5 1.0
OD2 A:ASP146 2.4 116.8 1.0
O A:HIS114 2.7 117.0 1.0
OD2 A:ASP196 2.7 132.5 1.0
CG A:ASP144 2.7 129.3 1.0
OD1 A:ASP144 2.9 141.2 1.0
CG A:ASN112 3.0 137.7 1.0
CG A:ASP196 3.1 135.7 1.0
CG A:ASP146 3.2 117.8 1.0
OD1 A:ASP196 3.2 142.4 1.0
CB A:ASP146 3.3 117.1 1.0
C A:ASN150 3.4 120.3 1.0
CB A:ASN150 3.6 117.5 1.0
C A:HIS114 3.8 124.6 1.0
CA A:ASN112 3.9 121.9 1.0
ND2 A:ASN112 3.9 141.8 1.0
CA A:ASN150 4.0 118.6 1.0
CB A:ASN112 4.0 126.5 1.0
CB A:ASP144 4.0 123.9 1.0
CB A:ASP196 4.2 126.8 1.0
OD1 A:ASP146 4.3 118.0 1.0
C A:ASN112 4.4 118.4 1.0
N A:HIS114 4.5 129.7 1.0
N A:ALA151 4.6 119.6 1.0
CA A:HIS114 4.6 123.1 1.0
N A:SER115 4.7 122.8 1.0
CB A:HIS114 4.8 120.0 1.0
CA A:ASP146 4.8 115.4 1.0
O A:ASN112 4.8 113.3 1.0
CA A:SER115 4.9 122.8 1.0
N A:ASP113 4.9 117.8 1.0
CB A:LEU204 4.9 128.7 1.0
CG A:ASN150 4.9 115.8 1.0
CD1 A:LEU204 5.0 128.0 1.0
CA A:ALA151 5.0 117.2 1.0

Calcium binding site 3 out of 15 in 8d40

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Calcium binding site 3 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 3 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca504

b:135.2
occ:1.00
OD2 A:ASP219 1.8 128.5 1.0
OE1 A:GLU183 2.3 131.4 1.0
OE1 A:GLU129 2.9 134.2 1.0
OD2 A:ASP181 2.9 156.4 1.0
CG A:ASP219 2.9 129.3 1.0
CG A:ASP181 3.3 146.4 1.0
OD1 A:ASP219 3.5 134.6 1.0
OD1 A:ASN130 3.5 115.5 1.0
CD A:GLU183 3.6 130.0 1.0
CD A:GLU129 3.6 129.9 1.0
OD1 A:ASP181 3.7 143.3 1.0
ND2 A:ASN130 3.7 129.5 1.0
CB A:ASP219 4.0 128.7 1.0
OE2 A:GLU129 4.0 132.6 1.0
CG A:ASN130 4.0 126.0 1.0
ND2 A:ASN220 4.2 134.0 1.0
CB A:ASP181 4.2 143.9 1.0
OE2 A:GLU183 4.2 117.5 1.0
CA A:ASP181 4.3 142.3 1.0
CG A:GLU129 4.6 127.6 1.0
CG A:GLU183 4.6 136.3 1.0
CA A:CA505 4.7 121.6 1.0
N A:ARG182 4.8 135.4 1.0
C A:ASP181 4.8 140.7 1.0
CB A:GLU183 4.8 139.5 1.0
N A:GLU183 4.9 135.9 1.0

Calcium binding site 4 out of 15 in 8d40

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Calcium binding site 4 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 4 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca505

b:121.6
occ:1.00
OE2 A:GLU183 1.8 117.5 1.0
OD1 A:ASP216 2.3 126.2 1.0
OE2 A:GLU129 2.4 132.6 1.0
O A:GLU217 2.4 123.5 1.0
OD1 A:ASP252 2.5 135.8 1.0
OD1 A:ASP219 2.6 134.6 1.0
CD A:GLU183 2.9 130.0 1.0
CG A:ASP252 3.4 128.9 1.0
N A:GLU217 3.4 129.3 1.0
CG A:ASP219 3.4 129.3 1.0
OE1 A:GLU183 3.4 131.4 1.0
CG A:ASP216 3.4 132.5 1.0
CD A:GLU129 3.4 129.9 1.0
C A:GLU217 3.5 129.1 1.0
OD2 A:ASP219 3.7 128.5 1.0
OE1 A:GLU129 3.8 134.2 1.0
NH1 A:ARG182 3.9 153.7 1.0
CB A:ASP252 4.0 124.1 1.0
CA A:GLU217 4.1 131.5 1.0
NE A:ARG182 4.1 148.1 1.0
CG A:GLU183 4.1 136.3 1.0
OD2 A:ASP216 4.2 140.5 1.0
OD2 A:ASP252 4.2 134.6 1.0
CA A:ASP216 4.3 134.7 1.0
CA A:ASP252 4.3 124.4 1.0
C A:ASP216 4.3 133.2 1.0
CB A:ASP216 4.4 133.4 1.0
CZ A:ARG182 4.5 154.8 1.0
ND2 A:ASN220 4.5 134.0 1.0
N A:ASP219 4.6 125.8 1.0
CB A:ASP219 4.6 128.7 1.0
N A:ASN218 4.6 130.3 1.0
CA A:CA504 4.7 135.2 1.0
CG A:GLU129 4.8 127.6 1.0
CB A:GLU217 4.8 139.1 1.0
CB A:ARG182 4.9 138.8 1.0

Calcium binding site 5 out of 15 in 8d40

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Calcium binding site 5 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 5 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca506

b:122.5
occ:1.00
OD2 A:ASP303 1.8 119.4 1.0
OD2 A:ASP250 2.2 125.1 1.0
OD2 A:ASP252 2.2 134.6 1.0
O A:ASN220 2.3 112.2 1.0
OD1 A:ASN218 2.6 151.5 1.0
O A:ASN256 2.6 91.9 1.0
CG A:ASP250 2.8 121.8 1.0
OD1 A:ASP250 2.8 119.3 1.0
CG A:ASP303 3.0 116.6 1.0
CG A:ASP252 3.2 128.9 1.0
CG A:ASN218 3.5 143.8 1.0
CB A:ASP252 3.5 124.1 1.0
C A:ASN220 3.5 121.0 1.0
OD1 A:ASP303 3.7 137.1 1.0
C A:ASN256 3.7 104.8 1.0
CB A:ASN256 4.0 119.4 1.0
ND2 A:ASN218 4.0 153.4 1.0
CB A:ASP303 4.1 102.1 1.0
N A:ASN220 4.1 127.2 1.0
CA A:ASN220 4.2 127.0 1.0
CB A:ASP250 4.3 121.3 1.0
CA A:ASN256 4.3 111.6 1.0
CA A:ASN218 4.3 126.6 1.0
OD1 A:ASP252 4.3 135.8 1.0
CB A:ASN220 4.5 131.4 1.0
N A:ASP219 4.5 125.8 1.0
CB A:ASN218 4.5 135.0 1.0
N A:TYR221 4.6 112.6 1.0
CA A:ASP252 4.7 124.4 1.0
N A:ALA257 4.8 108.2 1.0
C A:ASN218 4.8 125.9 1.0
N A:ASP252 4.8 123.7 1.0
CA A:TYR221 4.8 107.4 1.0
CD1 A:LEU309 4.9 118.2 1.0
C A:TYR221 4.9 107.3 1.0

Calcium binding site 6 out of 15 in 8d40

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Calcium binding site 6 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 6 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca507

b:175.7
occ:1.00
OD2 A:ASP325 2.1 119.9 1.0
OE1 A:GLU290 2.4 137.8 1.0
OD1 A:ASP288 2.5 148.1 1.0
CG A:ASP288 3.0 137.5 1.0
CG A:ASP325 3.0 131.6 1.0
OD2 A:ASP288 3.1 150.1 1.0
O A:HOH601 3.2 95.6 1.0
OE2 A:GLU235 3.2 111.6 1.0
OD1 A:ASP325 3.5 141.9 1.0
CD A:GLU290 3.6 128.3 1.0
ND2 A:ASN326 3.7 144.0 1.0
CA A:CA508 4.1 109.6 1.0
CB A:ASP325 4.2 137.3 1.0
CD A:GLU235 4.3 117.3 1.0
CB A:ASP288 4.3 127.4 1.0
CG A:GLU290 4.4 127.4 1.0
OE2 A:GLU290 4.4 120.2 1.0
CB A:GLU290 4.4 126.9 1.0
CA A:ASP288 4.6 118.3 1.0
CG A:ASN326 4.6 129.6 1.0
OE1 A:GLU235 4.7 122.2 1.0
N A:GLU290 4.8 113.2 1.0
OD1 A:ASN326 4.8 132.2 1.0
N A:PHE289 4.9 108.5 1.0

Calcium binding site 7 out of 15 in 8d40

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Calcium binding site 7 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 7 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca508

b:109.6
occ:1.00
OE1 A:GLU235 2.0 122.2 1.0
OE2 A:GLU290 2.4 120.2 1.0
OD1 A:ASP322 2.6 137.2 1.0
OD1 A:ASP358 2.6 134.1 1.0
O A:VAL323 2.7 131.9 1.0
OD1 A:ASP325 2.8 141.9 1.0
OE1 A:GLU290 2.8 137.8 1.0
CD A:GLU235 2.8 117.3 1.0
CD A:GLU290 2.9 128.3 1.0
OE2 A:GLU235 3.1 111.6 1.0
OD2 A:ASP325 3.1 119.9 1.0
CG A:ASP322 3.2 124.5 1.0
CG A:ASP325 3.2 131.6 1.0
OD2 A:ASP322 3.3 129.8 1.0
N A:VAL323 3.5 118.7 1.0
CG A:ASP358 3.6 135.0 1.0
C A:VAL323 3.8 128.2 1.0
CA A:CA507 4.1 175.7 1.0
ND2 A:ASN326 4.2 144.0 1.0
CA A:VAL323 4.2 124.6 1.0
CG A:GLU235 4.3 117.4 1.0
CA A:ASP322 4.3 113.6 1.0
CB A:ASP322 4.3 118.8 1.0
OD2 A:ASP358 4.4 150.8 1.0
C A:ASP322 4.4 115.2 1.0
N A:ASP325 4.4 142.7 1.0
CB A:ASP325 4.4 137.3 1.0
CB A:ASP358 4.4 124.0 1.0
CG A:GLU290 4.4 127.4 1.0
CA A:ASP358 4.4 114.5 1.0
CB A:PHE289 4.5 105.4 1.0
CB A:VAL323 4.9 127.1 1.0
N A:ASN324 5.0 132.8 1.0
CA A:ASP325 5.0 142.2 1.0

Calcium binding site 8 out of 15 in 8d40

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Calcium binding site 8 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 8 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Ca509

b:110.9
occ:1.00
OD2 A:ASP356 2.2 101.3 1.0
OD2 A:ASP358 2.3 150.8 1.0
O A:ASN326 2.4 132.0 1.0
O A:ASN362 2.5 103.0 1.0
OD2 A:ASP426 2.5 136.8 1.0
CG A:ASP426 3.0 125.9 1.0
ND2 A:ASN324 3.0 133.7 1.0
OD1 A:ASP426 3.0 138.4 1.0
CG A:ASP356 3.1 110.0 1.0
CG A:ASP358 3.3 135.0 1.0
OD1 A:ASP356 3.4 127.9 1.0
C A:ASN362 3.5 110.2 1.0
CB A:ASP358 3.5 124.0 1.0
C A:ASN326 3.6 132.6 1.0
CB A:ASN362 3.7 121.5 1.0
CA A:ASN362 3.7 113.6 1.0
CG A:ASN324 3.7 138.1 1.0
CA A:ASN324 3.9 135.4 1.0
CB A:ASN324 4.0 136.5 1.0
CB A:ASP426 4.3 117.5 1.0
N A:ASN326 4.4 127.8 1.0
CA A:ASN326 4.4 129.2 1.0
CB A:ASP356 4.4 111.0 1.0
OD1 A:ASP358 4.4 134.1 1.0
C A:ASN324 4.5 143.6 1.0
N A:GLU327 4.6 124.9 1.0
CG A:MET432 4.6 158.9 1.0
OD1 A:ASN324 4.7 154.6 1.0
CB A:MET432 4.7 148.0 1.0
N A:ALA363 4.7 114.0 1.0
CB A:ASN326 4.7 127.2 1.0
CG A:ASN362 4.8 124.7 1.0
CA A:GLU327 4.9 129.5 1.0
CA A:ASP358 4.9 114.5 1.0
N A:ASP325 4.9 142.7 1.0
CD A:PRO328 5.0 117.3 1.0

Calcium binding site 9 out of 15 in 8d40

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Calcium binding site 9 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 9 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca501

b:108.2
occ:1.00
OD1 B:ASP146 1.9 119.3 1.0
OE1 B:GLU79 2.3 133.6 1.0
OD1 B:ASP110 2.4 114.7 1.0
OE2 B:GLU21 2.4 143.7 1.0
OD1 B:ASP113 2.7 135.2 1.0
OE2 B:GLU79 2.8 132.6 1.0
O B:THR111 2.8 133.0 1.0
CD B:GLU79 2.9 132.9 1.0
CG B:ASP146 3.1 120.0 1.0
CD B:GLU21 3.3 139.3 1.0
NA B:NA502 3.5 103.7 1.0
CG B:ASP110 3.6 119.7 1.0
CG B:ASP113 3.6 135.7 1.0
OE1 B:GLU21 3.6 140.8 1.0
NH2 B:ARG78 3.8 123.1 1.0
N B:THR111 3.9 114.9 1.0
C B:THR111 4.0 126.6 1.0
OD2 B:ASP146 4.0 122.0 1.0
CB B:ASP146 4.1 119.5 1.0
CB B:ASP113 4.2 131.7 1.0
CA B:ASP146 4.2 118.4 1.0
CG B:GLU79 4.3 135.0 1.0
NE B:ARG78 4.4 118.2 1.0
OD2 B:ASP113 4.4 149.3 1.0
OD2 B:ASP110 4.4 131.2 1.0
N B:ASP113 4.4 129.1 1.0
CZ B:ARG78 4.5 121.1 1.0
CB B:ASP110 4.6 120.8 1.0
CA B:THR111 4.6 121.7 1.0
CA B:ASP110 4.6 120.5 1.0
CG B:GLU21 4.7 136.2 1.0
C B:ASP110 4.8 116.9 1.0
ND1 B:HIS114 4.8 123.7 1.0
OG1 B:THR111 4.9 127.1 1.0
CA B:ASP113 4.9 131.7 1.0
N B:ASN112 5.0 126.0 1.0

Calcium binding site 10 out of 15 in 8d40

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Calcium binding site 10 out of 15 in the Crystal Structure of Human CELSR1 EC1-4


Mono view


Stereo pair view

A full contact list of Calcium with other atoms in the Ca binding site number 10 of Crystal Structure of Human CELSR1 EC1-4 within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Ca503

b:125.8
occ:1.00
OD1 B:ASN112 2.0 158.3 1.0
OD2 B:ASP144 2.0 125.7 1.0
O B:HIS114 2.1 127.2 1.0
OD2 B:ASP196 2.1 136.7 1.0
OD2 B:ASP146 2.6 122.0 1.0
CG B:ASP196 2.9 134.5 1.0
CG B:ASP144 2.9 135.0 1.0
CG B:ASN112 3.2 139.3 1.0
OD1 B:ASP144 3.2 165.6 1.0
OD1 B:ASP196 3.3 151.8 1.0
C B:HIS114 3.3 137.3 1.0
CG B:ASP146 3.4 120.0 1.0
CB B:ASP146 3.4 119.5 1.0
CB B:ASN150 3.9 126.8 1.0
CB B:ASP196 4.0 127.7 1.0
CA B:ASN112 4.0 124.1 1.0
ND2 B:ASN112 4.0 150.8 1.0
N B:HIS114 4.1 134.9 1.0
CB B:ASN112 4.2 127.3 1.0
N B:ASP113 4.2 129.1 1.0
N B:ALA151 4.2 127.5 1.0
N B:SER115 4.3 134.1 1.0
CB B:ASP144 4.3 125.2 1.0
CA B:HIS114 4.3 135.8 1.0
CA B:SER115 4.4 141.4 1.0
C B:ASN112 4.5 125.8 1.0
OD1 B:ASP146 4.6 119.3 1.0
CA B:ASP146 4.8 118.4 1.0
CG B:ASN150 4.8 130.3 1.0
ND2 B:ASN150 4.8 137.7 1.0
C B:ASP113 4.8 140.0 1.0
CB B:HIS114 4.9 132.5 1.0
N B:ASP146 4.9 119.2 1.0
CA B:ASN150 4.9 128.1 1.0
CB B:LEU204 5.0 140.2 1.0
C B:ASN150 5.0 130.5 1.0

Reference:

E.Tamilselvan, M.Sotomayor. Crystal Structure of Human CELSR1 EC1-4 To Be Published.
Page generated: Fri Jul 19 07:51:11 2024

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