Chlorine in PDB 4gov: The Crystal Structure of Human Fascin 1 S39D Mutant

The structure of The Crystal Structure of Human Fascin 1 S39D Mutant, PDB code: 4gov was solved by S.Y.Yang, F.K.Huang, J.Huang, S.Chen, J.Jakoncic, A.Leo-Macias, R.Diaz-Avalos, L.Chen, J.J.Zhang, X.Y.Huang, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å)	30.00 / 2.20
Space group	C 1 2 1
Cell size a, b, c (Å), α, β, γ (°)	161.250, 70.723, 111.058, 90.00, 130.68, 90.00
R / Rfree (%)	19.6 / 23.4

The structure of The Crystal Structure of Human Fascin 1 S39D Mutant also contains other interesting chemical elements:

Bromine

(Br)

6 atoms

Pages:

>>> Page 1 <<< Page 2, Binding sites: 11 - 13;

Binding sites:

The binding sites of Chlorine atom in the The Crystal Structure of Human Fascin 1 S39D Mutant (pdb code 4gov). This binding sites where shown within 5.0 Angstroms radius around Chlorine atom.
In total 13 binding sites of Chlorine where determined in the The Crystal Structure of Human Fascin 1 S39D Mutant, PDB code: 4gov:
Jump to Chlorine binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Chlorine binding site 1 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 1 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl503 b:57.5 occ:1.00 NH2 A:ARG118 3.0 56.7 1.0 OG1 A:THR115 3.9 50.9 1.0 CG A:GLU116 3.9 55.5 1.0 CZ A:ARG118 4.2 58.0 1.0 NH1 A:ARG118 4.7 58.6 1.0 CB A:THR115 4.7 49.4 1.0 CD A:GLU116 4.8 58.8 1.0 OE2 A:GLU116 4.9 58.1 1.0 CB A:GLU116 4.9 53.6 1.0 O A:HOH826 4.9 76.3 1.0

Chlorine binding site 2 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 2 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl504 b:67.3 occ:1.00 CD A:ARG82 3.4 65.9 1.0 N A:GLU83 3.5 63.3 1.0 N A:VAL84 3.8 62.8 1.0 NE A:ARG82 3.9 69.4 1.0 NH1 A:ARG82 3.9 71.9 1.0 CA A:ARG82 3.9 60.4 1.0 CZ A:ARG82 4.1 72.1 1.0 CG A:ARG82 4.2 63.0 1.0 C A:ARG82 4.2 60.5 1.0 O A:VAL84 4.3 61.7 1.0 CB A:ARG82 4.3 60.6 1.0 CA A:GLU83 4.4 64.8 1.0 CB A:GLU83 4.4 69.1 1.0 CB A:VAL84 4.6 65.9 1.0 CG A:GLU83 4.6 72.2 1.0 C A:GLU83 4.6 63.1 1.0 CA A:VAL84 4.7 62.5 1.0 OE1 A:GLU83 4.7 78.6 1.0 C A:VAL84 5.0 61.1 1.0

Chlorine binding site 3 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 3 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl505 b:67.0 occ:1.00 O A:HOH808 3.2 43.3 1.0 O A:HOH709 3.4 42.3 1.0 CB A:ALA129 4.1 39.0 1.0

Chlorine binding site 4 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 4 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl506 b:36.9 occ:1.00 NH1 A:ARG167 3.3 46.6 1.0 O A:HOH836 3.3 56.6 1.0 N A:ASP168 3.5 44.1 1.0 N A:VAL169 3.6 42.5 1.0 CG2 A:VAL169 3.7 44.6 1.0 CG A:ARG167 3.9 44.8 1.0 O A:VAL169 3.9 39.9 1.0 CB A:ASP168 4.1 46.0 1.0 CA A:ASP168 4.1 44.5 1.0 C A:ASP168 4.3 43.8 1.0 C A:ARG167 4.4 44.6 1.0 CA A:ARG167 4.4 44.6 1.0 CD A:ARG167 4.4 44.7 1.0 CZ A:ARG167 4.4 46.6 1.0 CB A:ARG167 4.5 44.5 1.0 O A:HOH880 4.5 64.2 1.0 CA A:VAL169 4.5 42.5 1.0 OD2 A:ASP168 4.6 48.6 1.0 C A:VAL169 4.7 40.6 1.0 CB A:VAL169 4.7 44.2 1.0 NE A:ARG167 4.8 45.1 1.0 CG A:ASP168 4.9 47.2 1.0 OD2 A:ASP290 5.0 50.9 1.0

Chlorine binding site 5 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 5 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ A:Cl507 b:54.1 occ:1.00 O A:HOH633 2.9 50.9 1.0 O A:HOH628 3.1 44.5 1.0 NH2 A:ARG90 3.2 61.7 1.0 C A:PRO52 3.4 69.3 1.0 CD A:PRO52 3.5 68.7 1.0 O A:PRO52 3.6 72.9 1.0 NE A:ARG90 3.7 57.8 1.0 N A:PRO52 3.7 67.4 1.0 CB A:PRO51 3.9 60.5 1.0 CZ A:ARG90 3.9 58.1 1.0 CA A:PRO52 4.2 67.9 1.0 CB A:PRO85 4.2 58.3 1.0 O A:PRO85 4.4 62.4 1.0 CG A:PRO52 4.4 71.0 1.0 C A:PRO85 4.5 59.3 1.0 C A:PRO51 4.6 63.5 1.0 CA A:PRO51 4.6 60.8 1.0 N A:GLY86 4.9 57.6 1.0 CB A:PRO52 4.9 69.7 1.0 CD A:ARG90 4.9 52.8 1.0 CG A:PRO51 4.9 59.4 1.0 CA A:GLY86 5.0 53.8 1.0

Chlorine binding site 6 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 6 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl505 b:57.7 occ:1.00 N B:ASP420 3.2 54.6 1.0 O B:HOH758 3.6 57.8 1.0 CA B:ASP420 3.7 56.4 1.0 O B:HOH756 3.8 53.9 1.0 CE2 B:PHE418 3.9 44.2 1.0 CD2 B:PHE418 4.0 44.0 1.0 C B:ASN419 4.3 48.2 1.0 CA B:ASN419 4.5 48.7 1.0 CB B:ASP420 4.5 59.4 1.0 O B:PHE418 4.6 47.7 1.0 C B:ASP420 4.9 53.2 1.0

Chlorine binding site 7 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 7 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl506 b:65.3 occ:1.00 NZ B:LYS131 2.9 52.3 1.0 CD B:LYS131 3.6 49.4 1.0 N B:PRO128 3.7 48.6 1.0 O B:HOH784 3.7 54.1 1.0 CE B:LYS131 3.8 50.1 1.0 CD B:PRO128 3.8 51.3 1.0 C B:SER127 3.9 47.2 1.0 CG B:PRO128 3.9 51.6 1.0 CA B:PRO128 4.1 47.2 1.0 CA B:SER127 4.2 48.3 1.0 O B:SER127 4.4 45.6 1.0 O B:VAL126 4.5 48.9 1.0 CB B:PRO128 4.6 50.1 1.0 O B:HOH649 4.7 61.0 1.0 CG B:LYS131 4.9 47.0 1.0 N B:SER127 5.0 46.6 1.0 C B:VAL126 5.0 47.1 1.0 CG1 B:VAL126 5.0 44.2 1.0

Chlorine binding site 8 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 8 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl507 b:37.9 occ:1.00 O B:HOH859 3.4 64.2 1.0 NH2 B:ARG167 3.5 46.1 1.0 N B:ASP168 3.5 47.6 1.0 CG B:ARG167 3.7 46.0 1.0 N B:VAL169 3.9 46.6 1.0 CB B:ASP168 4.0 50.8 1.0 O B:VAL169 4.1 45.0 1.0 CG2 B:VAL169 4.1 47.6 1.0 CA B:ARG167 4.1 46.7 1.0 CB B:ARG167 4.2 45.8 1.0 CA B:ASP168 4.2 48.5 1.0 C B:ARG167 4.2 46.8 1.0 CD B:ARG167 4.2 45.3 1.0 OD2 B:ASP168 4.4 55.4 1.0 CG B:ASP168 4.4 53.3 1.0 CZ B:ARG167 4.5 46.1 1.0 C B:ASP168 4.6 46.8 1.0 O B:HOH642 4.7 66.7 1.0 O B:HOH765 4.7 70.7 1.0 OD2 B:ASP290 4.7 54.9 1.0 NE B:ARG167 4.8 45.7 1.0 CA B:VAL169 4.8 45.5 1.0 C B:VAL169 4.9 44.6 1.0

Chlorine binding site 9 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 9 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl508 b:62.4 occ:1.00 N B:PHE418 3.2 43.4 1.0 CA B:GLU417 3.8 43.5 1.0 O2 B:GOL514 3.9 43.8 1.0 CB B:PHE418 3.9 43.1 1.0 C B:GLU417 4.0 43.5 1.0 CA B:PHE418 4.1 44.1 1.0 O B:PHE418 4.2 47.7 1.0 O3 B:GOL514 4.2 42.3 1.0 CB B:GLU417 4.2 45.2 1.0 O B:HOH621 4.2 64.8 1.0 C B:PHE418 4.6 46.1 1.0 O B:LEU416 4.6 42.8 1.0 CG B:GLU417 4.7 46.7 1.0 C3 B:GOL514 4.8 41.4 1.0 O B:HOH798 4.8 54.7 1.0 O B:HOH756 5.0 53.9 1.0 C2 B:GOL514 5.0 41.6 1.0 N B:GLU417 5.0 42.2 1.0 CE B:LYS379 5.0 46.7 1.0

Chlorine binding site 10 out of 13 in the The Crystal Structure of Human Fascin 1 S39D Mutant


Mono view


Stereo pair view

A full contact list of Chlorine with other atoms in the Cl binding site number 10 of The Crystal Structure of Human Fascin 1 S39D Mutant within 5.0Å range: probe atom residue distance (Å) B Occ B:Cl509 b:56.6 occ:1.00 O B:HOH648 3.1 45.7 1.0 NH1 B:ARG185 3.1 50.5 1.0 NE2 B:GLN182 3.3 42.1 1.0 O B:HOH647 3.5 55.4 1.0 O B:GLN182 3.7 45.0 1.0 CG B:GLN182 3.9 42.0 1.0 CD B:ARG185 4.0 44.6 1.0 CD B:GLN182 4.1 41.8 1.0 CB B:ASP183 4.2 50.7 1.0 CG B:ARG185 4.2 43.5 1.0 CB B:ARG185 4.3 41.6 1.0 CZ B:ARG185 4.3 49.2 1.0 CA B:PRO208 4.3 44.2 1.0 C B:GLN182 4.6 43.4 1.0 NE B:ARG185 4.6 47.4 1.0 N B:ARG185 4.8 43.2 1.0 O B:GLU207 4.8 43.8 1.0 CB B:GLN182 4.8 40.3 1.0 O B:HOH656 4.9 52.7 1.0 O B:HOH747 4.9 73.1 1.0 CA B:GLY211 4.9 38.5 1.0 N B:PRO208 4.9 45.1 1.0 CB B:PRO208 4.9 45.2 1.0 O B:PRO208 5.0 41.6 1.0

S.Yang, F.K.Huang, J.Huang, S.Chen, J.Jakoncic, A.Leo-Macias, R.Diaz-Avalos, L.Chen, J.J.Zhang, X.Y.Huang. Molecular Mechanism of Fascin Function in Filopodial Formation. J.Biol.Chem. V. 288 274 2013.
ISSN: ISSN 0021-9258
PubMed: 23184945
DOI: 10.1074/JBC.M112.427971