 |
PDBsum entry 3thy
|
|
|
|
 |
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
 |
|
|
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
|
|
|
|
|
|
|
|
|
|
Pore analysis for: 3thy calculated with MOLE 2.0
|
PDB id
|
|
|
|
3thy
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
 |
Pores calculated on whole structure |
 |
Pores calculated excluding ligands
|
|
|
 |
 |
 |
 |
 |
|
 |
|
|
|
 |
 |
|
 |
|
|
|
 |
20 pores,
coloured by radius |
 |
18 pores,
coloured by radius
|
18 pores,
coloured as in list below
|
|
|
 |
 |
 |
Pores are connected internal spaces going through the structure. Only pores longer than 25 Å are shown. |
|
|
 |
|
|
|
 |
Free R
|
 |
|
|
|
|
 |
Length
|
 |
|
|
|
|
 |
HPathy
|
 |
|
|
|
|
 |
HPhob
|
 |
|
|
|
|
 |
Polar
|
 |
|
|
|
|
 |
Rel Mut
|
 |
|
|
|
|
 |
Residue..type
|
 |
|
|
|
|
 |
Ligands
|
 |
|
|
|
|
|
 |
Radius |
 |
1 |
 |
1.22 |
1.46 |
26.1 |
-1.07 |
-0.04 |
16.5 |
73 |
 |
3 |
2 |
2 |
4 |
2 |
0 |
0 |
 |
DT 40 E
|
 |
 |
2 |
 |
4.23 |
4.63 |
28.6 |
-1.07 |
-0.50 |
17.0 |
86 |
4 |
2 |
2 |
3 |
0 |
0 |
0 |
DT 40 E
|
 |
3 |
 |
1.33 |
1.34 |
34.2 |
-1.80 |
-0.27 |
23.8 |
76 |
7 |
2 |
2 |
4 |
2 |
0 |
0 |
|
 |
4 |
 |
3.37 |
3.52 |
40.0 |
-0.96 |
-0.55 |
10.9 |
90 |
2 |
2 |
2 |
3 |
0 |
0 |
0 |
DC 14 D DC 15 D DG 16 D DC 30 E DG 31 E DT 40 E DT 41 E
|
 |
5 |
 |
2.13 |
3.29 |
43.8 |
-1.41 |
-0.43 |
16.0 |
82 |
3 |
3 |
4 |
5 |
1 |
0 |
0 |
|
 |
6 |
 |
3.38 |
3.53 |
45.2 |
-0.72 |
-0.42 |
13.8 |
87 |
4 |
2 |
3 |
5 |
0 |
0 |
0 |
DC 14 D DC 15 D DG 16 D DC 30 E DG 31 E
|
 |
7 |
 |
2.12 |
3.28 |
48.7 |
-1.23 |
-0.39 |
15.3 |
86 |
4 |
4 |
5 |
7 |
0 |
0 |
0 |
|
 |
8 |
 |
1.33 |
1.48 |
62.1 |
-2.02 |
-0.52 |
20.2 |
84 |
5 |
5 |
8 |
3 |
3 |
0 |
0 |
|
 |
9 |
 |
1.40 |
3.73 |
70.1 |
-3.05 |
-0.62 |
35.5 |
76 |
10 |
8 |
2 |
0 |
2 |
1 |
0 |
|
 |
10 |
 |
1.28 |
3.21 |
75.3 |
-1.44 |
-0.25 |
17.4 |
82 |
8 |
6 |
5 |
6 |
4 |
3 |
0 |
|
 |
11 |
 |
2.43 |
2.86 |
91.7 |
-1.64 |
-0.33 |
23.2 |
81 |
8 |
7 |
4 |
3 |
2 |
0 |
0 |
DA 11 D DC 36 E DA 37 E DC 39 E DT 40 E
|
 |
12 |
 |
1.78 |
1.78 |
104.3 |
-1.35 |
-0.30 |
21.6 |
82 |
8 |
7 |
4 |
5 |
2 |
0 |
0 |
DT 9 D DG 10 D DA 11 D DC 36 E DA 37 E DC 39 E
|
 |
13 |
 |
1.35 |
3.15 |
122.6 |
-0.71 |
-0.31 |
12.9 |
86 |
7 |
5 |
11 |
11 |
4 |
1 |
1 |
|
 |
14 |
 |
1.24 |
2.26 |
129.1 |
-1.93 |
-0.47 |
20.1 |
81 |
14 |
10 |
5 |
4 |
5 |
5 |
0 |
|
 |
15 |
 |
1.91 |
3.51 |
131.1 |
-1.20 |
-0.44 |
15.7 |
88 |
11 |
6 |
13 |
12 |
2 |
0 |
0 |
ADP 935 A
|
 |
16 |
 |
1.89 |
3.40 |
136.2 |
-1.43 |
-0.52 |
16.3 |
88 |
10 |
5 |
15 |
12 |
1 |
0 |
0 |
|
 |
17 |
 |
1.50 |
3.16 |
139.4 |
-0.65 |
-0.31 |
12.3 |
85 |
11 |
5 |
12 |
12 |
5 |
1 |
1 |
|
 |
18 |
 |
1.27 |
2.42 |
208.1 |
-1.72 |
-0.46 |
19.5 |
84 |
20 |
14 |
14 |
11 |
6 |
5 |
0 |
ADP 935 A
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
Residue-type_colouring |
 |
|
 |
|
Positive
|
Negative
|
Neutral
|
Aliphatic
|
Aromatic
|
Pro & Gly
|
Cysteine
|
|
H,K,R
|
D,E
|
S,T,N,Q
|
A,V,L,I,M
|
F,Y,W
|
P,G
|
C
|
|
|
 |