Atomistry » Zinc » PDB 3dgl-3dsu » 3did
Atomistry »
  Zinc »
    PDB 3dgl-3dsu »
      3did »

Zinc in PDB 3did: Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked

Protein crystallography data

The structure of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked, PDB code: 3did was solved by L.C.Palmieri, J.B.B.Freire, D.Foguel, L.M.T.R.Lima, with X-Ray Crystallography technique. A brief refinement statistics is given in the table below:

Resolution Low / High (Å) 86.07 / 1.78
Space group P 1 21 1
Cell size a, b, c (Å), α, β, γ (°) 86.030, 63.470, 48.670, 90.00, 90.00, 90.00
R / Rfree (%) 18.1 / 24.2

Zinc Binding Sites:

Pages:

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

Binding sites:

The binding sites of Zinc atom in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked (pdb code 3did). This binding sites where shown within 5.0 Angstroms radius around Zinc atom.
In total 12 binding sites of Zinc where determined in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked, PDB code: 3did:
Jump to Zinc binding site number: 1; 2; 3; 4; 5; 6; 7; 8; 9; 10;

Zinc binding site 1 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 1 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 1 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn128

b:43.4
occ:0.40
OD2 A:ASP74 2.2 49.4 1.0
O A:HOH163 2.2 36.0 1.0
OD1 A:ASP74 2.4 42.2 1.0
CE1 A:HIS31 2.4 37.3 0.5
NE2 A:HIS31 2.5 33.2 0.5
CG A:ASP74 2.6 39.7 1.0
CD2 A:HIS31 2.9 34.5 0.5
ND1 A:HIS31 3.0 36.5 0.5
O A:HOH177 3.2 36.7 0.5
NE2 A:HIS31 3.6 34.5 0.5
CE1 A:HIS31 3.7 37.4 0.5
CB A:ASP74 4.1 34.2 1.0
CG A:HIS31 4.2 34.9 0.5
CG A:HIS31 4.2 34.4 0.5
NE2 A:HIS90 4.4 36.6 1.0
CD2 A:HIS31 4.5 34.9 0.5
ND1 A:HIS31 4.5 34.5 0.5
CD2 A:HIS90 4.6 37.8 1.0
O A:HOH165 4.7 47.5 1.0
CB A:ALA29 4.8 31.6 1.0

Zinc binding site 2 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 2 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 2 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn129

b:51.9
occ:0.75
ND1 A:HIS56 2.2 46.7 1.0
SG A:CYS10 2.3 56.7 1.0
O A:HOH195 2.6 58.1 1.0
O A:HOH136 2.6 56.1 1.0
CE1 A:HIS56 3.1 41.2 1.0
CG A:HIS56 3.3 42.7 1.0
CB A:CYS10 3.4 51.8 1.0
CB A:HIS56 3.8 42.6 1.0
N A:CYS10 3.9 53.1 1.0
NE2 A:HIS56 4.3 44.5 1.0
CA A:CYS10 4.3 51.6 1.0
CD2 A:HIS56 4.4 44.8 1.0
CA A:HIS56 4.4 41.9 1.0
CG A:MET13 4.6 37.5 1.0
CB A:MET13 4.8 36.9 1.0
N A:GLY57 5.0 44.9 1.0

Zinc binding site 3 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 3 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 3 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
A:Zn130

b:38.7
occ:1.00
OE1 A:GLU92 1.8 41.4 1.0
O A:HOH200 2.0 28.2 0.5
NE2 A:HIS88 2.1 30.5 1.0
ND1 A:HIS90 2.3 39.3 1.0
O A:HOH197 2.6 27.4 0.5
CD A:GLU92 2.9 44.6 1.0
CD2 A:HIS88 3.1 31.6 1.0
CE1 A:HIS88 3.1 28.6 1.0
CE1 A:HIS90 3.2 37.4 1.0
CG A:HIS90 3.3 35.9 1.0
OE2 A:GLU92 3.3 51.4 1.0
CB A:HIS90 3.6 35.1 1.0
OE2 A:GLU72 4.2 40.6 1.0
CG A:GLU92 4.2 43.1 1.0
ND1 A:HIS88 4.3 30.1 1.0
CG A:HIS88 4.3 29.9 1.0
NE2 A:HIS90 4.3 36.6 1.0
CD2 A:HIS90 4.4 37.8 1.0
CG1 B:VAL94 4.4 30.9 1.0
CD A:GLU72 4.6 36.2 1.0
N A:HIS90 4.6 33.7 1.0
CA A:HIS90 4.7 32.1 1.0
CG A:GLU89 4.7 41.3 1.0
CB B:VAL94 4.9 29.5 1.0
OE1 A:GLU72 5.0 38.1 1.0

Zinc binding site 4 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 4 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 4 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn128

b:51.3
occ:0.75
ND1 B:HIS56 2.2 42.5 1.0
O B:HOH202 2.2 58.1 1.0
SG B:CYS10 2.3 51.8 1.0
O B:HOH203 2.6 56.2 1.0
CG B:HIS56 3.1 40.8 1.0
CE1 B:HIS56 3.2 42.5 1.0
CB B:CYS10 3.3 48.8 1.0
CB B:HIS56 3.4 41.4 1.0
NE2 B:HIS56 4.3 43.9 1.0
CA B:HIS56 4.3 40.6 1.0
CD2 B:HIS56 4.3 40.9 1.0
N B:CYS10 4.3 51.5 1.0
CA B:CYS10 4.4 48.6 1.0
CG B:MET13 4.6 36.9 1.0
CB B:MET13 4.9 34.8 1.0
N B:GLY57 5.0 40.6 1.0

Zinc binding site 5 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 5 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 5 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn129

b:66.9
occ:0.50
OD2 B:ASP74 2.2 60.0 1.0
NE2 B:HIS31 2.5 38.3 0.5
CE1 B:HIS31 2.6 34.6 0.5
O B:HOH204 3.2 52.4 1.0
CG B:ASP74 3.3 55.4 1.0
NE2 B:HIS31 3.4 37.2 0.5
CE1 B:HIS31 3.4 41.2 0.5
CD2 B:HIS31 3.5 42.6 0.5
ND1 B:HIS31 3.6 37.9 0.5
OD1 B:ASP74 3.6 60.2 1.0
O B:HOH187 4.1 77.1 1.0
CB B:ALA29 4.1 43.9 1.0
ND1 B:HIS31 4.6 40.9 0.5
CB B:ASP74 4.6 49.2 1.0
CD2 B:HIS31 4.6 39.0 0.5
CG B:HIS31 4.6 39.8 0.5
CG B:HIS31 4.7 36.1 0.5

Zinc binding site 6 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 6 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 6 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
B:Zn130

b:42.5
occ:0.75
OE2 B:GLU92 2.0 47.2 1.0
ND1 B:HIS90 2.1 44.8 1.0
NE2 B:HIS88 2.2 40.4 1.0
O B:HOH213 2.3 29.6 0.5
O B:HOH193 2.6 32.9 0.5
CE1 B:HIS90 3.1 44.7 1.0
CD B:GLU92 3.1 48.7 1.0
CD2 B:HIS88 3.1 42.7 1.0
CG B:HIS90 3.2 43.4 1.0
CE1 B:HIS88 3.2 41.2 1.0
OE1 B:GLU92 3.4 52.2 1.0
CB B:HIS90 3.5 41.2 1.0
O B:HOH139 4.0 46.6 1.0
NE2 B:HIS90 4.2 46.0 1.0
CG B:HIS88 4.3 42.8 1.0
CD2 B:HIS90 4.3 44.3 1.0
ND1 B:HIS88 4.3 43.3 1.0
CG1 A:VAL94 4.4 38.3 1.0
CG B:GLU92 4.5 46.1 1.0
N B:HIS90 4.6 41.8 1.0
CA B:HIS90 4.6 41.4 1.0
OE1 B:GLU72 4.9 48.6 1.0
CB A:VAL94 4.9 38.1 1.0

Zinc binding site 7 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 7 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 7 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Zn128

b:34.5
occ:0.80
OE1 C:GLU92 1.9 42.1 1.0
NE2 C:HIS88 2.1 31.1 1.0
O C:HOH198 2.2 27.7 0.5
ND1 C:HIS90 2.3 40.1 1.0
O C:HOH193 2.5 28.5 0.5
CD2 C:HIS88 3.1 31.2 1.0
CE1 C:HIS88 3.1 29.4 1.0
CD C:GLU92 3.1 49.5 1.0
CE1 C:HIS90 3.2 38.4 1.0
CG C:HIS90 3.3 36.4 1.0
CB C:HIS90 3.6 33.5 1.0
OE2 C:GLU92 3.9 55.4 1.0
ND1 C:HIS88 4.2 32.3 1.0
CG C:GLU92 4.2 46.0 1.0
CG C:HIS88 4.2 31.5 1.0
OE2 C:GLU72 4.2 44.2 1.0
NE2 C:HIS90 4.4 37.4 1.0
O C:HOH171 4.4 54.2 1.0
CG1 D:VAL94 4.4 30.2 1.0
CD2 C:HIS90 4.4 39.2 1.0
N C:HIS90 4.6 32.2 1.0
CD C:GLU72 4.7 38.4 1.0
CA C:HIS90 4.7 30.6 1.0
OE1 C:GLU72 4.9 41.3 1.0
CB D:VAL94 4.9 29.4 1.0
CG C:GLU89 4.9 39.0 1.0
O C:HOH163 5.0 64.7 1.0
O C:HOH156 5.0 52.2 1.0

Zinc binding site 8 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 8 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 8 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Zn129

b:51.0
occ:0.50
OD2 C:ASP74 1.8 52.5 1.0
OD1 C:ASP74 2.4 45.5 1.0
CG C:ASP74 2.4 43.5 1.0
O C:HOH165 2.5 37.1 1.0
CE1 C:HIS31 2.5 33.4 0.5
NE2 C:HIS31 2.5 38.1 0.5
O C:HOH197 2.8 54.1 1.0
CD2 C:HIS31 3.0 36.3 0.5
ND1 C:HIS31 3.1 34.3 0.5
NE2 C:HIS31 3.6 34.4 0.5
CE1 C:HIS31 3.7 36.3 0.5
CB C:ASP74 3.9 36.0 1.0
O C:HOH179 4.2 56.0 1.0
CB C:ALA29 4.3 30.9 1.0
CG C:HIS31 4.3 35.8 0.5
CG C:HIS31 4.4 34.3 0.5
ND1 C:HIS31 4.6 36.8 0.5
CD2 C:HIS31 4.6 35.0 0.5
CA C:ASP74 4.9 34.5 1.0
NE2 C:HIS90 4.9 37.4 1.0
CD2 C:HIS90 5.0 39.2 1.0

Zinc binding site 9 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 9 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 9 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
C:Zn130

b:51.9
occ:0.75
CD2 C:HIS56 2.2 44.8 0.5
ND1 C:HIS56 2.3 38.2 0.5
SG C:CYS10 2.4 54.8 1.0
O C:HOH191 2.4 65.8 1.0
O C:HOH141 2.5 64.7 1.0
CE1 C:HIS56 3.1 36.0 0.5
CG C:HIS56 3.2 41.9 0.5
NE2 C:HIS56 3.2 42.7 0.5
CG C:HIS56 3.3 39.4 0.5
CB C:CYS10 3.4 51.8 1.0
CB C:HIS56 3.7 39.5 0.5
CB C:HIS56 3.7 40.7 0.5
N C:CYS10 4.0 54.2 1.0
NE2 C:HIS56 4.3 37.0 0.5
CA C:CYS10 4.3 52.2 1.0
CE1 C:HIS56 4.4 42.6 0.5
ND1 C:HIS56 4.4 43.1 0.5
CA C:HIS56 4.4 39.7 0.5
CA C:HIS56 4.4 40.3 0.5
CD2 C:HIS56 4.4 38.3 0.5
CG C:MET13 4.6 37.2 1.0
CB C:MET13 4.8 36.5 1.0
N C:GLY57 4.8 42.6 1.0

Zinc binding site 10 out of 12 in 3did

Go back to Zinc Binding Sites List in 3did
Zinc binding site 10 out of 12 in the Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked


Mono view


Stereo pair view

A full contact list of Zinc with other atoms in the Zn binding site number 10 of Crystal Structure of the F87M/L110M Mutant of Human Transthyretin at pH 4.6 Soaked within 5.0Å range:
probe atom residue distance (Å) B Occ
D:Zn128

b:71.5
occ:0.50
OE2 D:GLU72 2.2 51.4 1.0
CD2 D:HIS31 2.2 41.5 0.5
ND1 D:HIS31 2.3 37.4 0.5
OD1 D:ASP74 2.4 63.6 1.0
O D:HOH205 2.5 68.7 1.0
CE1 D:HIS31 2.9 38.2 0.5
NE2 D:HIS31 2.9 38.5 0.5
CG D:ASP74 3.2 56.7 1.0
CD D:GLU72 3.3 43.7 1.0
CG D:HIS31 3.3 38.7 0.5
O D:HOH176 3.3 63.4 1.0
OD2 D:ASP74 3.4 61.3 1.0
CG D:HIS31 3.4 36.7 0.5
O D:HOH200 3.6 48.4 1.0
CG D:GLU72 3.9 42.3 1.0
CB D:HIS31 4.0 34.8 0.5
CB D:HIS31 4.1 37.3 0.5
NE2 D:HIS31 4.1 36.6 0.5
CE1 D:HIS31 4.1 40.3 0.5
CD2 D:HIS90 4.2 48.0 1.0
ND1 D:HIS31 4.2 44.2 0.5
OE1 D:GLU72 4.3 43.8 1.0
NE2 D:HIS90 4.3 50.1 1.0
CD2 D:HIS31 4.3 37.3 0.5
O D:HOH197 4.4 66.8 1.0
O D:GLU72 4.4 37.5 1.0
CB D:GLU72 4.4 39.5 1.0
CB D:ASP74 4.6 51.5 1.0
N D:HIS31 4.7 36.3 0.5
N D:HIS31 4.7 35.5 0.5
C D:GLU72 4.9 39.4 1.0

Reference:

L.De.C.Palmieri, L.M.Lima, J.B.Freire, L.Bleicher, I.Polikarpov, F.C.Almeida, D.Foguel. Novel ZN2+-Binding Sites in Human Transthyretin: Implications For Amyloidogenesis and Retinol-Binding Protein Recognition. J.Biol.Chem. V. 285 31731 2010.
ISSN: ISSN 0021-9258
PubMed: 20659897
DOI: 10.1074/JBC.M110.157206
Page generated: Wed Dec 16 04:13:16 2020

Last articles

Zn in 8WB0
Zn in 8WAX
Zn in 8WAU
Zn in 8WAZ
Zn in 8WAY
Zn in 8WAV
Zn in 8WAW
Zn in 8WAT
Zn in 8W7M
Zn in 8WD3
© Copyright 2008-2020 by atomistry.com
Home   |    Site Map   |    Copyright   |    Contact us   |    Privacy