## |
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 |
|
L |
193 |
52 |
11148 |
◊ |
H |
x,y,z |
1_555 |
180 |
47 |
11665 |
1687.3 |
-23.1 |
0.107 |
21 |
2 |
0 |
1.000 |
2 |
|
H |
45 |
17 |
11665 |
◊ |
L |
x-1/2,-y-1/2,-z |
8_445 |
37 |
16 |
11148 |
390.3 |
-1.1 |
0.689 |
1 |
0 |
0 |
0.000 |
3 |
|
L |
33 |
12 |
11148 |
◊ |
H |
-x,y,-z+1/2 |
3_555 |
26 |
10 |
11665 |
279.1 |
-4.5 |
0.229 |
5 |
0 |
0 |
0.018 |
4 |
|
L |
27 |
7 |
11148 |
x |
L |
x-1/2,y-1/2,z |
5_445 |
32 |
14 |
11148 |
273.5 |
0.6 |
0.702 |
5 |
0 |
0 |
0.000 |
5 |
|
L |
29 |
12 |
11148 |
x |
L |
x-1/2,-y-1/2,-z |
8_445 |
27 |
7 |
11148 |
265.5 |
-2.2 |
0.410 |
1 |
0 |
0 |
0.000 |
6 |
|
H |
17 |
6 |
11665 |
x |
H |
x-1/2,-y-1/2,-z |
8_445 |
14 |
5 |
11665 |
159.9 |
-1.2 |
0.487 |
1 |
0 |
0 |
0.000 |
7 |
|
H |
18 |
6 |
11665 |
◊ |
H |
-x-1,y,-z+1/2 |
3_455 |
18 |
6 |
11665 |
137.9 |
0.4 |
0.771 |
2 |
0 |
0 |
0.000 |
8 |
|
H |
15 |
5 |
11665 |
◊ |
H |
x,-y,-z |
4_555 |
15 |
5 |
11665 |
125.3 |
1.7 |
0.879 |
7 |
0 |
0 |
0.000 |
9 |
|
H |
12 |
4 |
11665 |
◊ |
L |
x-1/2,y+1/2,z |
5_455 |
18 |
6 |
11148 |
119.0 |
-0.5 |
0.564 |
3 |
0 |
0 |
0.000 |
10 |
|
[BDP]A:2 |
9 |
1 |
299 |
f |
H |
x,y,z |
1_555 |
19 |
5 |
11665 |
95.5 |
0.1 |
0.363 |
3 |
0 |
0 |
0.042 |
11 |
|
H |
8 |
2 |
11665 |
◊ |
L |
x-1,y,z |
1_455 |
8 |
4 |
11148 |
81.2 |
0.4 |
0.739 |
1 |
0 |
0 |
0.000 |
12 |
|
[BGC]A:3 |
8 |
1 |
291 |
◊ |
L |
x,y,z |
1_555 |
9 |
3 |
11148 |
80.1 |
0.9 |
0.195 |
1 |
0 |
0 |
0.000 |
13 |
|
[BGC]A:1 |
9 |
1 |
301 |
f |
H |
x,y,z |
1_555 |
8 |
4 |
11665 |
78.0 |
1.9 |
0.394 |
1 |
0 |
0 |
0.000 |
14 |
|
[BDP]A:2 |
10 |
1 |
299 |
◊ |
L |
x,y,z |
1_555 |
9 |
4 |
11148 |
74.4 |
-0.3 |
0.168 |
0 |
0 |
0 |
0.010 |
15 |
|
[BGC]A:3 |
7 |
1 |
291 |
f |
H |
x,y,z |
1_555 |
8 |
3 |
11665 |
61.2 |
0.6 |
0.224 |
0 |
0 |
0 |
0.000 |
16 |
|
[BDP]A:2 |
5 |
1 |
299 |
cf |
[BGC]A:1 |
x,y,z |
1_555 |
6 |
1 |
301 |
58.9 |
1.0 |
0.160 |
0 |
0 |
0 |
0.000 |
17 |
|
L |
10 |
3 |
11148 |
◊ |
H |
x-1/2,-y-1/2,-z |
8_445 |
5 |
1 |
11665 |
57.4 |
0.6 |
0.782 |
3 |
0 |
0 |
0.000 |
18 |
|
[BDP]A:2 |
4 |
1 |
299 |
cf |
[BGC]A:3 |
x,y,z |
1_555 |
6 |
1 |
291 |
55.1 |
1.4 |
0.217 |
0 |
0 |
0 |
0.000 |
19 |
|
L |
6 |
2 |
11148 |
◊ |
L |
x,-y-1,-z |
4_545 |
6 |
2 |
11148 |
53.2 |
1.1 |
0.868 |
0 |
0 |
0 |
0.000 |
20 |
|
L |
8 |
5 |
11148 |
◊ |
H |
x-1/2,y-1/2,z |
5_445 |
5 |
1 |
11665 |
44.3 |
0.4 |
0.755 |
0 |
0 |
0 |
0.000 |
21 |
|
[BGC]A:1 |
4 |
1 |
301 |
◊ |
L |
x,y,z |
1_555 |
3 |
1 |
11148 |
32.9 |
-0.4 |
0.131 |
0 |
0 |
0 |
0.013 |
22 |
|
[BGC]A:3 |
3 |
1 |
291 |
◊ |
[BGC]A:1 |
x,-y,-z |
4_555 |
2 |
1 |
301 |
31.9 |
1.2 |
0.357 |
0 |
0 |
0 |
0.000 |
23 |
|
L |
2 |
1 |
11148 |
◊ |
L |
x,-y,-z |
4_555 |
2 |
1 |
11148 |
25.6 |
-0.5 |
0.274 |
0 |
0 |
0 |
0.000 |
24 |
|
[BGC]A:3 |
3 |
1 |
291 |
◊ |
[BGC]A:3 |
x,-y,-z |
4_555 |
3 |
1 |
291 |
24.8 |
0.9 |
0.274 |
0 |
0 |
0 |
0.000 |
25 |
|
[BDP]A:2 |
1 |
1 |
299 |
◊ |
[BGC]A:3 |
x,-y,-z |
4_555 |
2 |
1 |
291 |
14.3 |
0.7 |
0.257 |
0 |
0 |
0 |
0.000 |
26 |
|
L |
2 |
2 |
11148 |
◊ |
L |
-x,y,-z+1/2 |
3_555 |
2 |
2 |
11148 |
13.0 |
-0.2 |
0.462 |
0 |
0 |
0 |
0.000 |
27 |
|
L |
1 |
1 |
11148 |
◊ |
[BGC]A:3 |
x-1/2,-y-1/2,-z |
8_445 |
3 |
1 |
291 |
7.2 |
-0.0 |
0.238 |
0 |
0 |
0 |
0.000 |
28 |
|
[BGC]A:3 |
1 |
1 |
291 |
◊ |
L |
x,-y,-z |
4_555 |
1 |
1 |
11148 |
5.9 |
-0.0 |
0.232 |
0 |
0 |
0 |
0.000 |
29 |
|
[BGC]A:1 |
1 |
1 |
301 |
◊ |
H |
x,-y,-z |
4_555 |
1 |
1 |
11665 |
1.1 |
0.0 |
0.290 |
0 |
0 |
0 |
0.000 |
30 |
|
[BGC]A:3 |
1 |
1 |
291 |
f |
[BGC]A:1 |
x,y,z |
1_555 |
1 |
1 |
301 |
1.1 |
0.0 |
0.174 |
0 |
0 |
0 |
0.000 |
|