| ## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
| Id |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
| 1 |
1 |
|
B |
213 |
58 |
17091 |
◊ |
A |
-y,x-y,z |
3_555 |
185 |
47 |
17164 |
1974.3 |
-9.9 |
0.302 |
21 |
6 |
0 |
0.302 |
2 |
|
A |
208 |
58 |
17164 |
◊ |
B |
-y+1,x-y+1,z |
3_665 |
184 |
47 |
17091 |
1938.0 |
-10.2 |
0.294 |
18 |
5 |
0 |
0.302 |
| Average: |
1956.2 |
-10.0 |
0.298 |
20 |
6 |
0 |
0.302 |
| 2 |
3 |
|
B |
43 |
14 |
17091 |
◊ |
A |
x,y,z |
1_555 |
39 |
13 |
17164 |
378.0 |
3.0 |
0.831 |
5 |
8 |
0 |
0.000 |
| 3 |
4 |
|
B |
41 |
13 |
17091 |
◊ |
B |
-x,-x+y,-z |
9_555 |
41 |
13 |
17091 |
313.7 |
0.3 |
0.684 |
4 |
2 |
0 |
0.000 |
| 4 |
5 |
|
B |
28 |
8 |
17091 |
◊ |
B |
x,x-y+1,-z+1/2 |
12_565 |
30 |
8 |
17091 |
245.9 |
-5.2 |
0.107 |
0 |
0 |
0 |
0.039 |
6 |
|
A |
28 |
8 |
17164 |
◊ |
A |
x,x-y,-z+1/2 |
12_555 |
27 |
8 |
17164 |
242.3 |
-5.2 |
0.096 |
0 |
0 |
0 |
0.039 |
| Average: |
244.1 |
-5.2 |
0.101 |
0 |
0 |
0 |
0.039 |
| 5 |
7 |
|
[DN7]B:401 |
15 |
1 |
394 |
f |
A |
x,y,z |
1_555 |
26 |
8 |
17164 |
173.8 |
1.6 |
0.100 |
1 |
0 |
0 |
0.000 |
| 6 |
8 |
|
[DN7]B:401 |
16 |
1 |
394 |
◊ |
B |
x,y,z |
1_555 |
23 |
8 |
17091 |
166.8 |
3.8 |
0.222 |
0 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[EPE]A:404 |
11 |
1 |
391 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
17164 |
155.3 |
3.9 |
0.158 |
1 |
0 |
0 |
0.000 |
| 8 |
10 |
|
[SO4]A:402 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
22 |
9 |
17164 |
129.4 |
-19.0 |
0.728 |
8 |
0 |
0 |
0.175 |
| 9 |
11 |
|
[SO4]B:403 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
17091 |
128.0 |
-19.1 |
0.736 |
7 |
0 |
0 |
0.172 |
| 10 |
12 |
|
[SO4]A:401 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
17164 |
113.3 |
-18.0 |
0.760 |
10 |
0 |
0 |
0.173 |
| 11 |
13 |
|
[GOL]A:403 |
6 |
1 |
221 |
◊ |
A |
x,y,z |
1_555 |
16 |
5 |
17164 |
113.3 |
0.4 |
0.664 |
1 |
0 |
0 |
0.000 |
| 12 |
14 |
|
[SO4]B:402 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
20 |
9 |
17091 |
113.1 |
-18.5 |
0.757 |
8 |
0 |
0 |
0.171 |
| 13 |
15 |
|
[GOL]B:404 |
6 |
1 |
223 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
17091 |
99.7 |
-0.6 |
0.452 |
3 |
0 |
0 |
0.015 |
| 14 |
16 |
|
A |
12 |
5 |
17164 |
◊ |
A |
y,x,-z |
11_555 |
12 |
5 |
17164 |
95.9 |
0.5 |
0.702 |
0 |
0 |
0 |
0.000 |
| 15 |
17 |
|
B |
5 |
3 |
17091 |
◊ |
[EPE]A:404 |
-y,x-y,z |
3_555 |
3 |
1 |
391 |
32.6 |
0.6 |
0.207 |
0 |
0 |
0 |
0.000 |
| 16 |
18 |
|
B |
3 |
1 |
17091 |
f |
[GOL]A:403 |
-y,x-y,z |
3_555 |
3 |
1 |
221 |
31.1 |
-1.0 |
0.234 |
0 |
0 |
0 |
0.008 |
| 17 |
19 |
|
A |
1 |
1 |
17164 |
x |
A |
-y+1,x-y,z |
3_655 |
1 |
1 |
17164 |
4.9 |
0.4 |
0.862 |
0 |
0 |
0 |
0.000 |
20 |
|
B |
1 |
1 |
17091 |
x |
B |
-y,x-y+1,z |
3_565 |
1 |
1 |
17091 |
3.9 |
0.3 |
0.843 |
0 |
0 |
0 |
0.000 |
| Average: |
4.4 |
0.3 |
0.853 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
A |
1 |
1 |
17164 |
f |
[EPE]A:404 |
-y,x-y,z |
3_555 |
1 |
1 |
391 |
2.9 |
0.1 |
0.387 |
0 |
0 |
0 |
0.000 |
|