 |
PDBsum entry 4r6a
|
|
|
|
 |
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
 |
|
|
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
|
|
|
|
|
|
|
|
|
|
Pore analysis for: 4r6a calculated with MOLE 2.0
|
PDB id
|
|
|
|
4r6a
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
|
 |
Pores calculated on whole structure |
 |
Pores calculated excluding ligands
|
|
|
 |
 |
 |
 |
 |
|
 |
|
|
|
 |
 |
|
 |
|
|
|
 |
5 pores,
coloured by radius |
 |
17 pores,
coloured by radius
|
17 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 |
 |
2.07 |
2.25 |
41.3 |
-0.92 |
0.09 |
20.6 |
82 |
 |
7 |
0 |
3 |
7 |
4 |
1 |
0 |
 |
NAG 2 D BMA 3 D
|
 |
 |
2 |
 |
1.68 |
1.74 |
48.9 |
0.15 |
-0.11 |
4.1 |
74 |
2 |
1 |
5 |
2 |
5 |
1 |
0 |
|
 |
3 |
 |
1.19 |
1.37 |
54.1 |
0.52 |
0.28 |
9.4 |
85 |
3 |
1 |
2 |
11 |
5 |
2 |
0 |
HB2 901 B
|
 |
4 |
 |
1.18 |
1.37 |
56.0 |
0.39 |
0.35 |
10.7 |
82 |
6 |
1 |
3 |
8 |
6 |
1 |
0 |
HB2 901 B NAG 2 D BMA 3 D
|
 |
5 |
 |
1.38 |
2.58 |
56.2 |
-0.89 |
0.36 |
14.8 |
76 |
7 |
1 |
4 |
2 |
8 |
2 |
0 |
NAG 1 G NAG 2 G BMA 3 G
|
 |
6 |
 |
2.09 |
2.26 |
61.3 |
-1.24 |
0.06 |
22.8 |
85 |
8 |
4 |
5 |
9 |
3 |
1 |
0 |
NAG 1 D NAG 2 D BMA 3 D NAG 1 E NAG 2 E BMA 3 E
|
 |
7 |
 |
1.19 |
1.37 |
66.4 |
-0.41 |
-0.13 |
7.2 |
83 |
2 |
2 |
6 |
5 |
5 |
2 |
0 |
HB2 901 B NAG 911 B
|
 |
8 |
 |
1.19 |
1.38 |
71.1 |
-0.03 |
0.08 |
7.4 |
81 |
4 |
1 |
6 |
5 |
6 |
2 |
0 |
HB2 901 B NAG 911 B
|
 |
9 |
 |
1.37 |
2.69 |
72.8 |
-0.53 |
0.12 |
12.1 |
79 |
5 |
3 |
7 |
8 |
8 |
2 |
1 |
NAG 1 G NAG 2 G BMA 3 G NAG 1 H NAG 2 H BMA 3 H
|
 |
10 |
 |
1.19 |
1.38 |
73.6 |
-0.33 |
0.24 |
15.9 |
85 |
7 |
4 |
5 |
10 |
5 |
1 |
0 |
HB2 901 B NAG 1 D NAG 2 D BMA 3 D NAG 1 E NAG 2 E BMA 3 E
|
 |
11 |
 |
1.44 |
1.52 |
85.5 |
-1.00 |
-0.17 |
17.9 |
78 |
10 |
2 |
4 |
7 |
1 |
2 |
0 |
|
 |
12 |
 |
1.35 |
2.61 |
129.1 |
-1.04 |
-0.13 |
15.8 |
75 |
11 |
5 |
7 |
8 |
8 |
3 |
1 |
|
 |
13 |
 |
1.56 |
1.61 |
139.5 |
-1.93 |
-0.25 |
24.8 |
80 |
16 |
7 |
8 |
9 |
5 |
1 |
0 |
NAG 1 G NAG 2 G BMA 3 G NAG 1 H NAG 2 H
|
 |
14 |
 |
1.38 |
1.65 |
162.8 |
-1.80 |
-0.35 |
23.6 |
80 |
13 |
4 |
9 |
5 |
6 |
0 |
0 |
NAG 2 D BMA 3 D
|
 |
15 |
 |
1.35 |
1.74 |
176.2 |
-0.85 |
-0.25 |
13.2 |
77 |
7 |
2 |
8 |
12 |
3 |
3 |
0 |
|
 |
16 |
 |
1.44 |
2.72 |
189.5 |
-1.16 |
-0.17 |
18.8 |
80 |
16 |
5 |
12 |
8 |
9 |
2 |
0 |
|
 |
17 |
 |
1.46 |
1.81 |
210.1 |
-1.73 |
-0.27 |
23.2 |
83 |
21 |
7 |
14 |
10 |
6 |
0 |
0 |
MAN 4 F NAG 1 G NAG 2 G BMA 3 G NAG 1 H NAG 2 H
|
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
 |
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
|
|
|
 |