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PDBsum entry 3wa9
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Pore analysis for: 3wa9 calculated with MOLE 2.0
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PDB id
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3wa9
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Pores calculated on whole structure |
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Pores calculated excluding ligands
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29 pores,
coloured by radius |
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29 pores,
coloured by radius
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29 pores,
coloured as in list below
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Pores are connected internal spaces going through the structure. Only pores longer than 25 Å are shown. |
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Free R
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Length
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HPathy
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HPhob
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Polar
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Rel Mut
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Residue..type
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Ligands
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Radius |
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1 |
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3.80 |
3.80 |
25.3 |
-1.82 |
-0.69 |
24.1 |
85 |
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3 |
1 |
1 |
1 |
0 |
0 |
0 |
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DG 59 I DA 133 I DG 134 I DA 165 J DT 239 J
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2 |
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3.12 |
3.12 |
25.3 |
-0.91 |
-0.30 |
16.5 |
79 |
2 |
0 |
2 |
1 |
0 |
0 |
0 |
DG 18 I DT 90 I DT 91 I DT 92 I DT 93 I DC 195 J DT 198 J DC 199 J DA 200 J DA 201 J DG 271 J
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3 |
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3.39 |
3.39 |
25.7 |
-0.67 |
-0.77 |
6.6 |
83 |
1 |
0 |
0 |
0 |
0 |
0 |
0 |
DA 7 I DT 8 I DC 16 I DT 92 I DT 93 I DG 205 J DC 206 J DG 280 J DG 281 J DT 282 J
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4 |
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3.65 |
3.78 |
29.3 |
-0.30 |
-0.25 |
6.7 |
95 |
2 |
0 |
4 |
2 |
1 |
0 |
0 |
DT 48 I DT 120 I DG 121 I DT 123 I DA 124 I DA 165 J DT 167 J DC 168 J DT 169 J DA 170 J DC 171 J
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5 |
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3.63 |
3.81 |
30.7 |
-1.65 |
-0.72 |
20.1 |
85 |
3 |
1 |
1 |
1 |
0 |
0 |
0 |
DA 7 I DT 8 I DG 18 I DT 92 I DC 195 J DG 205 J DC 206 J DG 271 J DG 280 J DG 281 J DT 282 J
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6 |
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2.84 |
2.88 |
30.8 |
-0.90 |
-0.81 |
7.9 |
108 |
1 |
0 |
4 |
0 |
0 |
0 |
0 |
DG 46 I DC 47 I DT 48 I DT 123 I DA 124 I DA 165 J DA 173 J DT 251 J
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7 |
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2.04 |
2.04 |
37.5 |
-0.78 |
-0.78 |
8.0 |
81 |
2 |
1 |
0 |
0 |
0 |
0 |
0 |
DG 58 I DG 59 I DC 60 I DA 61 I DT 62 I DG 63 I D A 133 I DG 134 I DG 233 J DC 234 J DC 235 J DT 236 J DT 237 J DT 238 J DT 239 J
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8 |
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2.84 |
2.88 |
39.5 |
-0.30 |
-0.45 |
5.8 |
95 |
1 |
0 |
3 |
2 |
1 |
0 |
0 |
DG 46 I DC 47 I DT 48 I DT 120 I DG 121 I DT 123 I DA 124 I DT 167 J DC 168 J DT 169 J DA 170 J DC 171 J DA 173 J DT 251 J
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9 |
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1.37 |
1.39 |
41.3 |
-1.42 |
-0.56 |
18.5 |
80 |
5 |
0 |
1 |
1 |
0 |
1 |
0 |
DA 72 I DA 77 I DG 78 I DC 79 I DG 214 J DC 215 J DT 216 J DG 217 J DA 218 J DA 219 J
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10 |
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3.03 |
3.03 |
60.3 |
-2.23 |
-0.44 |
26.6 |
85 |
8 |
1 |
4 |
2 |
1 |
1 |
0 |
DA 28 I DA 29 I DA 30 I DG 31 I DT 32 I DC 195 J DT 258 J DA 259 J DC 260 J DA 261 J DT 264 J DT 265 J
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11 |
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1.80 |
4.41 |
74.9 |
-2.13 |
-0.55 |
22.5 |
84 |
13 |
2 |
8 |
2 |
3 |
1 |
0 |
DT 48 I DA 165 J
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12 |
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2.37 |
2.37 |
78.2 |
-1.40 |
-0.43 |
19.5 |
76 |
5 |
0 |
0 |
2 |
0 |
1 |
0 |
DA 7 I DT 8 I DC 9 I DC 10 I DT 74 I DG 205 J DC 215 J DT 216 J DG 217 J DA 218 J DA 219 J DT 220 J DA 279 J DG 280 J DT 282 J DT 288 J DT 289 J DG 290 J
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13 |
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2.05 |
2.76 |
80.5 |
-2.07 |
-0.42 |
21.9 |
87 |
11 |
2 |
11 |
2 |
4 |
1 |
0 |
DT 48 I DA 165 J DC 195 J
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14 |
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1.77 |
4.37 |
81.7 |
-2.11 |
-0.52 |
23.3 |
81 |
13 |
2 |
4 |
2 |
3 |
1 |
0 |
DG 46 I DC 47 I DT 48 I DA 124 I DA 173 J DG 249 J DT 250 J DT 251 J DT 252 J
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15 |
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2.00 |
2.80 |
87.3 |
-2.07 |
-0.39 |
22.7 |
83 |
11 |
2 |
7 |
2 |
4 |
1 |
0 |
DG 46 I DC 47 I DT 48 I DA 124 I DA 173 J DC 195 J DG 249 J DT 250 J DT 251 J DT 252 J
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16 |
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1.80 |
2.10 |
88.3 |
-1.60 |
-0.34 |
26.1 |
79 |
9 |
4 |
1 |
3 |
1 |
1 |
0 |
DA 7 I DT 8 I DC 9 I DC 10 I DG 205 J DA 279 J DG 280 J DT 282 J
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17 |
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2.37 |
2.37 |
101.2 |
-1.26 |
-0.53 |
16.8 |
84 |
7 |
1 |
4 |
2 |
0 |
2 |
0 |
DC 9 I DC 10 I DG 18 I DT 74 I DT 92 I DC 195 J DC 215 J DT 216 J DG 217 J DA 218 J DA 219 J DT 220 J DA 279 J DG 280 J DT 288 J DT 289 J DG 290 J
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18 |
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1.19 |
1.20 |
114.7 |
-1.00 |
-0.55 |
11.9 |
91 |
6 |
0 |
3 |
3 |
1 |
0 |
0 |
DG 31 I DT 32 I DG 40 I DA 41 I DA 42 I DG 46 I DC 47 I DT 48 I DA 124 I DA 173 J DG 249 J DT 250 J DT 251 J DT 252 J DA 257 J DT 258 J DT 264 J DT 265 J
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19 |
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2.38 |
2.38 |
113.1 |
-1.61 |
-0.50 |
20.8 |
79 |
7 |
0 |
1 |
2 |
0 |
1 |
0 |
DA 7 I DT 8 I DC 9 I DC 10 I DA 72 I DA 73 I DT 74 I DT 75 I DG 205 J DC 215 J DT 216 J DA 279 J DG 280 J DT 282 J DT 288 J DT 289 J DG 290 J
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20 |
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1.31 |
1.32 |
114.0 |
-1.27 |
-0.55 |
15.9 |
81 |
6 |
0 |
1 |
2 |
0 |
2 |
0 |
DC 9 I DC 10 I DC 16 I DA 77 I DG 78 I DC 79 I DT 92 I DT 93 I DG 205 J DC 206 J DG 214 J DC 215 J DT 216 J DG 217 J DA 218 J DA 219 J DA 279 J DG 280 J DG 281 J DT 288 J DT 289 J DG 290 J
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21 |
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1.49 |
1.51 |
118.5 |
-1.04 |
-0.54 |
11.6 |
93 |
6 |
0 |
6 |
4 |
1 |
0 |
0 |
DG 31 I DT 32 I DG 40 I DA 41 I DA 42 I DT 48 I D A 165 J DG 249 J DT 250 J DA 257 J DT 258 J DT 264 J DT 265 J
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22 |
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1.61 |
1.63 |
126.9 |
-2.29 |
-0.40 |
27.9 |
82 |
19 |
2 |
4 |
4 |
4 |
1 |
0 |
DA 28 I DA 29 I DA 30 I DG 31 I DT 32 I DT 258 J DA 259 J DC 260 J DA 261 J DT 264 J DT 265 J
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23 |
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1.77 |
4.36 |
126.6 |
-1.67 |
-0.49 |
21.1 |
84 |
13 |
5 |
6 |
3 |
2 |
1 |
0 |
DA 7 I DT 8 I DC 9 I DC 10 I DT 48 I DA 165 J DG 205 J DA 279 J DG 280 J DT 282 J
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24 |
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1.28 |
1.29 |
136.7 |
-1.39 |
-0.46 |
20.4 |
81 |
11 |
4 |
1 |
4 |
1 |
2 |
0 |
DC 9 I DC 10 I DA 77 I DG 78 I DC 79 I DG 214 J DC 215 J DT 216 J DG 217 J DA 218 J DA 219 J DT 288 J DT 289 J DG 290 J
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25 |
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1.74 |
4.44 |
147.4 |
-1.52 |
-0.49 |
19.9 |
81 |
13 |
5 |
3 |
3 |
2 |
1 |
0 |
DC 10 I DC 16 I DG 46 I DC 47 I DT 48 I DT 92 I DT 93 I DA 124 I DA 173 J DG 205 J DC 206 J DG 249 J DT 250 J DT 251 J DT 252 J DA 279 J DG 280 J DG 281 J
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26 |
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1.78 |
2.06 |
145.9 |
-1.46 |
-0.39 |
23.1 |
81 |
12 |
4 |
2 |
4 |
1 |
1 |
0 |
DC 9 I DC 10 I DA 72 I DA 73 I DT 74 I DT 75 I DC 215 J DT 216 J DT 288 J DT 289 J DG 290 J
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27 |
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1.36 |
1.35 |
185.6 |
-1.49 |
-0.50 |
18.2 |
83 |
15 |
5 |
5 |
5 |
3 |
2 |
0 |
DC 9 I DC 10 I DA 77 I DG 78 I DC 79 I DT 120 I DG 121 I DT 123 I DT 167 J DC 168 J DT 169 J DA 170 J DC 171 J DG 214 J DC 215 J DT 216 J DG 217 J DA 218 J DA 219 J DT 288 J DT 289 J DG 290 J
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28 |
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1.80 |
4.40 |
191.1 |
-1.54 |
-0.49 |
20.2 |
81 |
16 |
5 |
3 |
4 |
2 |
1 |
0 |
DC 9 I DC 10 I DG 46 I DC 47 I DT 48 I DA 72 I DA 73 I DT 74 I DT 75 I DA 124 I DA 173 J DC 215 J DT 216 J DG 249 J DT 250 J DT 251 J DT 252 J DT 288 J DT 289 J DG 290 J
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29 |
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1.76 |
4.40 |
191.7 |
-1.51 |
-0.47 |
18.8 |
83 |
16 |
5 |
5 |
5 |
3 |
1 |
0 |
DC 9 I DC 10 I DT 74 I DT 120 I DG 121 I DT 123 I DT 167 J DC 168 J DT 169 J DA 170 J DC 171 J DC 215 J DT 216 J DG 217 J DA 218 J DA 219 J DT 220 J DT 288 J DT 289 J DG 290 J
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Residue-type_colouring |
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Positive
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Negative
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Neutral
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Aliphatic
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Aromatic
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Pro & Gly
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Cysteine
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H,K,R
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D,E
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S,T,N,Q
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A,V,L,I,M
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F,Y,W
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P,G
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C
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