 |
PDBsum entry 2xxa
|
|
|
|
 |
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
 |
|
|
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
|
|
|
|
|
|
|
|
|
|
Pore analysis for: 2xxa calculated with MOLE 2.0
|
PDB id
|
|
|
|
2xxa
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
 |
Pores calculated on whole structure |
 |
Pores calculated excluding ligands
|
|
|
 |
 |
 |
 |
 |
|
 |
|
|
|
 |
 |
|
 |
|
|
|
 |
24 pores,
coloured by radius |
 |
27 pores,
coloured by radius
|
27 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 |
 |
2.24 |
2.38 |
32.2 |
-2.60 |
-0.78 |
29.2 |
80 |
 |
5 |
6 |
1 |
0 |
0 |
0 |
0 |
 |
|
 |
 |
2 |
 |
2.10 |
2.36 |
36.4 |
-1.23 |
-0.45 |
19.8 |
84 |
4 |
2 |
1 |
2 |
0 |
0 |
0 |
C 31 F G 32 F C 60 F C 61 F A 62 F
|
 |
3 |
 |
2.58 |
2.59 |
40.5 |
-2.50 |
-0.69 |
28.7 |
79 |
6 |
4 |
2 |
0 |
0 |
0 |
0 |
G 12 G C 13 G G 80 G G 82 G U 92 G C 93 G
|
 |
4 |
 |
3.78 |
3.78 |
40.5 |
-2.69 |
-0.76 |
31.3 |
78 |
8 |
6 |
2 |
0 |
0 |
0 |
0 |
G 12 F C 13 F C 77 F G 78 F G 79 F G 80 F G 82 F C 93 F A 34 G C 36 G A 64 G A 65 G
|
 |
5 |
 |
1.29 |
1.51 |
41.2 |
-0.60 |
-0.07 |
17.6 |
71 |
4 |
4 |
2 |
4 |
2 |
1 |
0 |
|
 |
6 |
 |
1.36 |
1.46 |
44.7 |
-2.57 |
-0.80 |
28.7 |
81 |
6 |
6 |
2 |
0 |
0 |
0 |
0 |
G 12 G C 13 G G 80 G G 82 G U 92 G C 93 G
|
 |
7 |
 |
1.28 |
1.72 |
45.2 |
-0.78 |
-0.21 |
18.3 |
73 |
4 |
5 |
2 |
4 |
2 |
1 |
0 |
|
 |
8 |
 |
1.42 |
1.53 |
51.6 |
-2.13 |
-0.68 |
24.6 |
78 |
7 |
4 |
3 |
1 |
0 |
0 |
0 |
G 12 G C 13 G G 80 G G 82 G U 91 G
|
 |
9 |
 |
1.60 |
1.60 |
53.1 |
-0.45 |
-0.80 |
4.0 |
83 |
1 |
0 |
0 |
0 |
0 |
0 |
0 |
C 21 G G 22 G C 23 G G 24 G G 25 G A 26 G C 27 G G 28 G C 29 G A 64 G G 66 G G 67 G G 68 G A 69 G U 70 G G 71 G
|
 |
10 |
 |
1.39 |
1.49 |
55.8 |
-2.27 |
-0.77 |
25.6 |
80 |
7 |
5 |
3 |
1 |
0 |
0 |
0 |
G 12 G C 13 G G 80 G G 82 G U 91 G
|
 |
11 |
 |
1.18 |
1.35 |
58.9 |
-1.48 |
-0.21 |
30.6 |
73 |
6 |
5 |
2 |
5 |
2 |
0 |
0 |
|
 |
12 |
 |
2.87 |
3.12 |
70.0 |
-1.68 |
-0.62 |
22.0 |
83 |
7 |
4 |
2 |
1 |
0 |
0 |
0 |
G 12 G C 13 G G 20 G C 21 G G 22 G G 71 G C 72 G G 80 G U 81 G G 82 G C 83 G U 92 G C 93 G
|
 |
13 |
 |
2.58 |
2.59 |
73.2 |
-1.87 |
-0.67 |
23.2 |
82 |
7 |
6 |
3 |
1 |
0 |
0 |
0 |
G 20 G C 21 G G 22 G G 71 G C 72 G G 80 G U 81 G G 82 G C 83 G
|
 |
14 |
 |
2.20 |
2.33 |
80.6 |
-1.95 |
-0.69 |
26.5 |
82 |
7 |
6 |
2 |
1 |
0 |
0 |
0 |
G 20 G C 21 G G 22 G G 71 G C 72 G G 80 G U 81 G G 82 G C 83 G
|
 |
15 |
 |
1.42 |
1.52 |
81.1 |
-1.49 |
-0.63 |
19.3 |
81 |
8 |
4 |
4 |
2 |
0 |
0 |
0 |
G 12 G C 13 G G 20 G C 21 G G 22 G G 71 G C 72 G G 80 G U 81 G G 82 G C 83 G U 91 G
|
 |
16 |
 |
1.30 |
1.30 |
81.5 |
-0.31 |
-0.17 |
15.9 |
75 |
6 |
4 |
3 |
5 |
2 |
1 |
0 |
C 13 G G 20 G C 21 G G 22 G G 71 G C 72 G G 80 G U 81 G G 82 G C 83 G
|
 |
17 |
 |
1.59 |
1.59 |
100.8 |
-0.40 |
-0.80 |
3.4 |
117 |
0 |
0 |
1 |
0 |
0 |
0 |
0 |
C 16 F G 17 F C 18 F A 19 F G 20 F C 21 F G 22 F C 23 F G 24 F G 25 F G 67 F G 68 F A 69 F U 70 F G 71 F U 74 F U 75 F C 77 F G 78 F G 79 F G 24 G G 25 G A 26 G C 27 G G 28 G C 29 G C 36 G A 64 G A 65 G G 66 G G 67 G
|
 |
18 |
 |
1.61 |
1.61 |
106.0 |
-0.99 |
-0.75 |
9.8 |
79 |
4 |
1 |
1 |
0 |
0 |
0 |
0 |
G 12 G C 13 G A 14 G G 15 G C 16 G G 17 G C 18 G A 19 G G 20 G C 21 G G 22 G C 23 G G 24 G G 25 G A 26 G C 27 G G 28 G C 29 G A 64 G G 66 G G 67 G G 68 G A 69 G U 70 G G 71 G U 73 G U 74 G U 75 G G 76 G C 77 G G 79 G U 81 G G 82 G C 83 G U 92 G C 93 G
|
 |
19 |
 |
1.61 |
1.61 |
108.5 |
-1.41 |
-0.75 |
15.6 |
78 |
4 |
4 |
1 |
0 |
0 |
0 |
0 |
C 13 G A 14 G G 15 G C 16 G G 17 G C 18 G A 19 G G 20 G C 21 G G 22 G C 23 G G 24 G G 25 G A 26 G C 27 G G 28 G C 29 G A 64 G G 66 G G 67 G G 68 G A 69 G U 70 G G 71 G U 73 G U 74 G U 75 G G 76 G C 77 G G 79 G G 80 G U 81 G G 82 G
|
 |
20 |
 |
1.87 |
1.87 |
119.3 |
-0.52 |
-0.80 |
4.5 |
94 |
2 |
0 |
1 |
0 |
0 |
0 |
0 |
C 16 F G 17 F C 18 F A 19 F G 20 F C 21 F G 22 F C 23 F G 24 F G 67 F G 68 F A 69 F U 70 F G 71 F U 74 F U 75 F C 77 F G 78 F G 79 F C 21 G G 22 G C 23 G G 24 G C 36 G A 65 G G 67 G G 68 G A 69 G U 70 G G 71 G
|
 |
21 |
 |
1.33 |
1.37 |
139.1 |
-1.28 |
-0.34 |
21.0 |
81 |
9 |
11 |
4 |
9 |
5 |
1 |
0 |
GCP 600 A GCP 600 B G 12 G U 92 G C 93 G
|
 |
22 |
 |
1.84 |
1.83 |
147.4 |
-2.26 |
-0.64 |
27.3 |
82 |
15 |
13 |
6 |
2 |
2 |
1 |
0 |
GCP 600 A GCP 600 B G 12 G U 92 G C 93 G
|
 |
23 |
 |
1.16 |
3.74 |
195.6 |
-1.01 |
-0.27 |
22.9 |
79 |
15 |
10 |
2 |
18 |
1 |
1 |
0 |
G 12 F C 13 F G 80 F G 82 F C 93 F
|
 |
24 |
 |
2.50 |
2.50 |
197.4 |
-1.50 |
-0.74 |
16.8 |
79 |
9 |
7 |
3 |
0 |
0 |
0 |
0 |
G 12 F C 13 F A 14 F G 15 F C 16 F G 17 F C 18 F A 19 F G 20 F C 21 F G 22 F C 23 F G 24 F G 67 F G 68 F A 69 F U 70 F G 71 F U 74 F U 75 F C 77 F G 79 F U 81 F G 82 F C 93 F C 13 G A 14 G G 15 G C 16 G G 17 G C 18 G A 19 G G 20 G C 21 G G 22 G C 23 G G 24 G G 25 G G 67 G G 68 G A 69 G U 70 G G 71 G U 73 G U 74 G U 75 G G 76 G C 77 G G 79 G G 80 G U 81 G G 82 G
|
 |
25 |
 |
1.19 |
3.55 |
216.8 |
-0.46 |
-0.12 |
19.8 |
80 |
11 |
5 |
0 |
18 |
1 |
1 |
0 |
C 77 F G 78 F G 79 F G 80 F A 34 G C 36 G A 64 G A 65 G
|
 |
26 |
 |
1.37 |
1.77 |
283.4 |
-1.43 |
-0.61 |
19.6 |
81 |
14 |
8 |
4 |
5 |
0 |
0 |
0 |
G 20 F C 21 F G 22 F C 23 F G 24 F G 67 F G 68 F A 69 F U 70 F G 71 F C 72 F G 80 F U 81 F G 82 F C 83 F C 13 G A 14 G G 15 G C 16 G G 17 G C 18 G A 19 G G 20 G C 21 G G 22 G C 23 G G 24 G G 25 G G 67 G G 68 G A 69 G U 70 G G 71 G U 73 G U 74 G U 75 G G 76 G C 77 G G 79 G G 80 G U 81 G G 82 G
|
 |
27 |
 |
1.29 |
3.86 |
294.4 |
-0.71 |
-0.36 |
17.6 |
80 |
14 |
7 |
2 |
17 |
1 |
1 |
0 |
G 20 F C 21 F G 22 F C 23 F G 24 F G 67 F G 68 F A 69 F U 70 F G 71 F C 72 F G 80 F U 81 F G 82 F C 83 F C 21 G G 22 G C 23 G G 24 G G 67 G G 68 G A 69 G U 70 G G 71 G
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
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
|
|
|
 |