## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
B |
354 |
94 |
17002 |
◊ |
A |
x,y,z |
1_555 |
347 |
80 |
17344 |
3242.8 |
-17.8 |
0.408 |
67 |
10 |
0 |
0.606 |
2 |
|
A |
56 |
16 |
17344 |
x |
A |
x-y+1,x-1,z+1/6 |
6_645 |
56 |
16 |
17344 |
548.7 |
-1.4 |
0.326 |
7 |
4 |
0 |
0.000 |
3 |
|
[HFP]B:2001 |
18 |
1 |
565 |
f |
B |
x,y,z |
1_555 |
44 |
17 |
17002 |
274.0 |
-2.1 |
0.472 |
5 |
0 |
0 |
0.078 |
4 |
|
A |
37 |
10 |
17344 |
◊ |
B |
x,y,z-1 |
1_554 |
25 |
6 |
17002 |
265.9 |
-2.7 |
0.245 |
3 |
2 |
0 |
0.000 |
5 |
|
P |
18 |
3 |
712 |
◊ |
B |
x,y,z |
1_555 |
49 |
18 |
17002 |
263.8 |
-7.6 |
0.414 |
3 |
0 |
0 |
0.161 |
6 |
|
A |
21 |
8 |
17344 |
◊ |
B |
-x+3,-y+2,z-1/2 |
4_874 |
26 |
7 |
17002 |
196.5 |
-0.6 |
0.495 |
3 |
0 |
0 |
0.000 |
7 |
|
P |
14 |
3 |
712 |
◊ |
A |
x,y,z |
1_555 |
23 |
7 |
17344 |
147.2 |
-1.9 |
0.537 |
1 |
0 |
0 |
0.022 |
8 |
|
[HFP]B:2001 |
12 |
1 |
565 |
◊ |
A |
x,y,z |
1_555 |
18 |
5 |
17344 |
120.9 |
1.2 |
0.562 |
1 |
0 |
0 |
0.000 |
9 |
|
[ACT]A:2002 |
3 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
17344 |
102.3 |
-0.4 |
0.525 |
0 |
0 |
0 |
0.100 |
10 |
|
[HFP]B:2001 |
12 |
1 |
565 |
◊ |
P |
x,y,z |
1_555 |
12 |
4 |
712 |
99.5 |
-0.7 |
0.709 |
0 |
0 |
0 |
0.012 |
11 |
|
B |
12 |
5 |
17002 |
◊ |
A |
-y+2,x-y,z+1/3 |
2_755 |
11 |
5 |
17344 |
86.0 |
-0.3 |
0.591 |
0 |
0 |
0 |
0.000 |
12 |
|
B |
6 |
4 |
17002 |
x |
B |
-y+2,x-y,z+1/3 |
2_755 |
10 |
5 |
17002 |
60.5 |
-0.9 |
0.307 |
0 |
0 |
0 |
0.000 |
13 |
|
[ACE]P:0 |
3 |
1 |
172 |
cf |
P |
x,y,z |
1_555 |
5 |
2 |
712 |
57.0 |
-0.7 |
0.869 |
0 |
0 |
0 |
0.100 |
14 |
|
[ACT]A:2002 |
3 |
1 |
183 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
17002 |
52.6 |
-0.4 |
0.662 |
0 |
0 |
0 |
0.005 |
15 |
|
B |
4 |
1 |
17002 |
x |
B |
-y+2,x-y,z-2/3 |
2_754 |
7 |
3 |
17002 |
41.6 |
-0.1 |
0.636 |
0 |
0 |
0 |
0.000 |
16 |
|
[ZN]B:1000 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
4 |
17002 |
37.3 |
-27.4 |
0.000 |
0 |
0 |
0 |
0.494 |
17 |
|
[ZN]B:1000 |
1 |
1 |
98 |
◊ |
P |
x,y,z |
1_555 |
2 |
1 |
712 |
27.4 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.218 |
18 |
|
[ACE]P:0 |
2 |
1 |
172 |
◊ |
B |
x,y,z |
1_555 |
5 |
4 |
17002 |
21.8 |
-0.5 |
0.648 |
0 |
0 |
0 |
0.010 |
19 |
|
A |
3 |
2 |
17344 |
x |
A |
-y+2,x-y,z-2/3 |
2_754 |
3 |
1 |
17344 |
12.8 |
-0.2 |
0.477 |
0 |
0 |
0 |
0.000 |
20 |
|
[ACE]P:0 |
1 |
1 |
172 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
17344 |
6.8 |
0.1 |
0.678 |
0 |
0 |
0 |
0.000 |
21 |
|
[ACE]P:0 |
1 |
1 |
172 |
◊ |
[ZN]B:1000 |
x,y,z |
1_555 |
1 |
1 |
98 |
2.0 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.013 |
22 |
|
[ACE]P:0 |
1 |
1 |
172 |
◊ |
[HFP]B:2001 |
x,y,z |
1_555 |
1 |
1 |
565 |
0.1 |
-0.0 |
0.516 |
0 |
0 |
0 |
0.000 |
|