| ## |
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 |
|
D |
128 |
34 |
20744 |
◊ |
C |
x,y,z |
1_555 |
130 |
36 |
19166 |
1223.7 |
-8.6 |
0.309 |
19 |
2 |
0 |
0.829 |
2 |
|
B |
130 |
33 |
19501 |
◊ |
A |
x,y,z |
1_555 |
130 |
32 |
20544 |
1221.4 |
-9.5 |
0.262 |
18 |
2 |
0 |
0.829 |
| Average: |
1222.6 |
-9.0 |
0.286 |
19 |
2 |
0 |
0.829 |
| 2 |
3 |
|
A |
45 |
13 |
20544 |
◊ |
C |
x,y-1,z |
1_545 |
59 |
19 |
19166 |
450.0 |
0.8 |
0.768 |
4 |
1 |
0 |
0.000 |
| 3 |
4 |
|
B |
51 |
15 |
19501 |
◊ |
A |
x-1,y,z |
1_455 |
48 |
12 |
20544 |
429.9 |
-1.5 |
0.490 |
4 |
2 |
0 |
0.000 |
5 |
|
D |
51 |
14 |
20744 |
◊ |
C |
x-1,y,z |
1_455 |
54 |
18 |
19166 |
410.6 |
-3.0 |
0.416 |
4 |
0 |
0 |
0.000 |
| Average: |
420.2 |
-2.3 |
0.453 |
4 |
1 |
0 |
0.000 |
| 4 |
6 |
|
A |
42 |
14 |
20544 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
52 |
17 |
20544 |
424.7 |
-6.5 |
0.117 |
2 |
1 |
0 |
0.000 |
| 5 |
7 |
|
A |
46 |
16 |
20544 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
42 |
14 |
19166 |
398.6 |
0.3 |
0.723 |
7 |
5 |
0 |
0.000 |
| 6 |
8 |
|
D |
39 |
10 |
20744 |
x |
D |
-x-1,y-1/2,-z |
2_445 |
48 |
16 |
20744 |
393.8 |
-4.3 |
0.115 |
2 |
0 |
0 |
0.000 |
| 7 |
9 |
|
B |
45 |
14 |
19501 |
◊ |
C |
x-1,y-1,z |
1_445 |
31 |
11 |
19166 |
355.7 |
-3.6 |
0.276 |
2 |
0 |
0 |
0.000 |
| 8 |
10 |
|
D |
38 |
11 |
20744 |
◊ |
B |
x,y,z |
1_555 |
46 |
12 |
19501 |
327.2 |
-2.4 |
0.411 |
4 |
0 |
0 |
0.000 |
| 9 |
11 |
|
B |
15 |
4 |
19501 |
◊ |
C |
-x,y-1/2,-z+1 |
2_546 |
24 |
6 |
19166 |
209.2 |
-2.2 |
0.150 |
2 |
0 |
0 |
0.000 |
12 |
|
A |
25 |
6 |
20544 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
19 |
4 |
20744 |
205.4 |
-2.1 |
0.195 |
3 |
2 |
0 |
0.000 |
| Average: |
207.3 |
-2.2 |
0.173 |
3 |
1 |
0 |
0.000 |
| 10 |
13 |
|
B |
18 |
7 |
19501 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
25 |
10 |
20744 |
185.7 |
-0.8 |
0.531 |
0 |
1 |
0 |
0.000 |
| 11 |
14 |
|
[EDO]C:601 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
25 |
13 |
19166 |
123.5 |
3.7 |
0.627 |
2 |
0 |
0 |
0.000 |
| 12 |
15 |
|
[EDO]C:602 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
25 |
9 |
19166 |
122.6 |
2.9 |
0.401 |
0 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[EDO]B:602 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
24 |
8 |
19501 |
122.4 |
2.8 |
0.386 |
0 |
0 |
0 |
0.000 |
| 14 |
17 |
|
[EDO]D:601 |
4 |
1 |
183 |
f |
D |
x,y,z |
1_555 |
24 |
12 |
20744 |
121.4 |
3.9 |
0.639 |
3 |
0 |
0 |
0.000 |
| 15 |
18 |
|
[EDO]B:601 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
22 |
12 |
19501 |
118.5 |
3.9 |
0.636 |
2 |
0 |
0 |
0.000 |
| 16 |
19 |
|
B |
8 |
3 |
19501 |
◊ |
C |
-x-1,y-1/2,-z |
2_445 |
10 |
3 |
19166 |
68.9 |
-0.3 |
0.534 |
0 |
0 |
0 |
0.000 |
20 |
|
A |
3 |
1 |
20544 |
◊ |
D |
-x-1,y-1/2,-z |
2_445 |
3 |
2 |
20744 |
25.0 |
-0.8 |
0.214 |
0 |
0 |
0 |
0.000 |
| Average: |
46.9 |
-0.6 |
0.374 |
0 |
0 |
0 |
0.000 |
| 17 |
21 |
|
[CL]D:603 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
14 |
7 |
20744 |
68.5 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.444 |
22 |
|
[CL]A:601 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
20544 |
67.4 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.444 |
23 |
|
[CL]C:604 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
19166 |
66.4 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.444 |
| Average: |
67.4 |
-9.5 |
0.000 |
0 |
0 |
0 |
0.444 |
| 18 |
24 |
|
[CL]C:603 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
7 |
19166 |
66.0 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.385 |
25 |
|
[CL]D:602 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
13 |
8 |
20744 |
63.9 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.385 |
| Average: |
64.9 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.385 |
| 19 |
26 |
|
B |
8 |
4 |
19501 |
◊ |
D |
x,y-1,z |
1_545 |
5 |
3 |
20744 |
26.5 |
0.4 |
0.699 |
0 |
0 |
0 |
0.000 |
| 20 |
27 |
|
[EDO]C:602 |
2 |
1 |
186 |
f |
[CL]C:603 |
x,y,z |
1_555 |
1 |
1 |
125 |
9.5 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.017 |
| 21 |
28 |
|
D |
1 |
1 |
20744 |
◊ |
[CL]D:602 |
-x-1,y-1/2,-z |
2_445 |
1 |
1 |
125 |
4.0 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 22 |
29 |
|
B |
1 |
1 |
19501 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
2 |
1 |
20544 |
1.4 |
0.0 |
0.649 |
0 |
0 |
0 |
0.000 |
|