| ## |
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 |
258 |
60 |
13414 |
◊ |
A |
x,y,z |
1_555 |
261 |
70 |
23142 |
2542.3 |
-20.6 |
0.081 |
39 |
4 |
0 |
0.763 |
| 2 |
2 |
|
D |
128 |
10 |
2823 |
◊ |
A |
x,y,z |
1_555 |
138 |
39 |
23142 |
1163.5 |
-3.4 |
0.434 |
19 |
0 |
0 |
0.637 |
| 3 |
3 |
|
H |
98 |
11 |
2702 |
◊ |
G |
x,y,z |
1_555 |
99 |
11 |
2704 |
791.1 |
7.0 |
0.975 |
33 |
0 |
0 |
0.116 |
| 4 |
4 |
|
A |
75 |
23 |
23142 |
◊ |
A |
x,x-y,-z+1/6 |
12_555 |
74 |
23 |
23142 |
682.4 |
2.9 |
0.756 |
6 |
2 |
0 |
0.000 |
| 5 |
5 |
|
B |
39 |
10 |
13414 |
◊ |
A |
x,x-y+1,-z+1/6 |
12_565 |
45 |
15 |
23142 |
414.0 |
-4.0 |
0.236 |
5 |
0 |
0 |
0.008 |
| 6 |
6 |
|
D |
39 |
5 |
2823 |
◊ |
B |
x,y,z |
1_555 |
43 |
15 |
13414 |
364.6 |
-1.6 |
0.633 |
7 |
0 |
0 |
0.070 |
| 7 |
7 |
|
A |
44 |
14 |
23142 |
◊ |
A |
x,x-y+1,-z+1/6 |
12_565 |
45 |
14 |
23142 |
343.6 |
0.8 |
0.642 |
6 |
0 |
0 |
0.001 |
| 8 |
8 |
|
A |
37 |
14 |
23142 |
x |
A |
x-y,x,z+1/6 |
6_555 |
29 |
11 |
23142 |
314.5 |
3.1 |
0.823 |
6 |
2 |
0 |
0.000 |
| 9 |
9 |
|
G |
22 |
4 |
2704 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
23142 |
182.5 |
-1.7 |
0.518 |
3 |
0 |
0 |
0.000 |
| 10 |
10 |
|
H |
25 |
5 |
2702 |
◊ |
B |
x,x-y+1,-z+1/6 |
12_565 |
16 |
5 |
13414 |
173.8 |
-2.0 |
0.564 |
2 |
0 |
0 |
0.000 |
| 11 |
11 |
|
A |
23 |
10 |
23142 |
◊ |
G |
x-y,x,z+1/6 |
6_555 |
17 |
3 |
2704 |
158.6 |
-1.5 |
0.543 |
2 |
0 |
0 |
0.000 |
| 12 |
12 |
|
A |
17 |
7 |
23142 |
◊ |
D |
x-y,x,z+1/6 |
6_555 |
14 |
3 |
2823 |
116.8 |
-1.4 |
0.553 |
3 |
0 |
0 |
0.000 |
| 13 |
13 |
|
[CL]A:1005 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
23142 |
52.5 |
-6.7 |
0.000 |
0 |
0 |
0 |
0.363 |
| 14 |
14 |
|
[NA]G:1004 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
15 |
8 |
2702 |
46.8 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.225 |
15 |
|
[NA]G:1001 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
11 |
8 |
2704 |
45.5 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.225 |
| Average: |
46.2 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.225 |
| 15 |
16 |
|
[NA]G:1004 |
1 |
1 |
125 |
◊ |
G |
x,y,z |
1_555 |
8 |
3 |
2704 |
45.7 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.176 |
17 |
|
[NA]G:1001 |
1 |
1 |
125 |
◊ |
H |
x,y,z |
1_555 |
9 |
3 |
2702 |
45.3 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.176 |
| Average: |
45.5 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.176 |
| 16 |
18 |
|
[CL]A:1005 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
13414 |
42.6 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.104 |
| 17 |
19 |
|
[NA]H:1003 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
13 |
7 |
2702 |
41.9 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.190 |
20 |
|
[NA]G:1002 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
13 |
7 |
2704 |
41.9 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.190 |
| Average: |
41.9 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.190 |
| 18 |
21 |
|
B |
1 |
1 |
13414 |
◊ |
B |
x,x-y,-z+1/6 |
12_555 |
1 |
1 |
13414 |
41.9 |
1.0 |
0.946 |
0 |
0 |
0 |
0.000 |
| 19 |
22 |
|
[NA]H:1003 |
1 |
1 |
125 |
◊ |
G |
x,y,z |
1_555 |
12 |
6 |
2704 |
41.8 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.187 |
23 |
|
[NA]G:1002 |
1 |
1 |
125 |
◊ |
H |
x,y,z |
1_555 |
12 |
6 |
2702 |
41.2 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.187 |
| Average: |
41.5 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.187 |
| 20 |
24 |
|
H |
6 |
3 |
2702 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
23142 |
36.6 |
0.5 |
0.699 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
A |
3 |
2 |
23142 |
◊ |
A |
y,x,-z+1/3 |
7_555 |
3 |
2 |
23142 |
34.8 |
1.7 |
0.934 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
B |
3 |
1 |
13414 |
◊ |
A |
y,x,-z+1/3 |
7_555 |
1 |
1 |
23142 |
13.5 |
-0.0 |
0.341 |
0 |
0 |
0 |
0.000 |
| 23 |
27 |
|
[NA]G:1002 |
1 |
1 |
125 |
f |
[NA]G:1001 |
x,y,z |
1_555 |
1 |
1 |
125 |
13.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.040 |
| 24 |
28 |
|
H |
3 |
1 |
2702 |
◊ |
A |
x,x-y+1,-z+1/6 |
12_565 |
1 |
1 |
23142 |
13.0 |
-0.0 |
0.582 |
0 |
0 |
0 |
0.000 |
| 25 |
29 |
|
[NA]H:1003 |
1 |
1 |
125 |
f |
[NA]G:1004 |
x,y,z |
1_555 |
1 |
1 |
125 |
11.9 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.036 |
| 26 |
30 |
|
[NA]H:1003 |
1 |
1 |
125 |
◊ |
[NA]G:1002 |
x,y,z |
1_555 |
1 |
1 |
125 |
9.7 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.030 |
| 27 |
31 |
|
A |
1 |
1 |
23142 |
◊ |
H |
x-y,x,z+1/6 |
6_555 |
1 |
1 |
2702 |
6.2 |
0.1 |
0.446 |
0 |
0 |
0 |
0.000 |
| 28 |
32 |
|
A |
2 |
1 |
23142 |
◊ |
H |
x-y,-y+1,-z |
8_565 |
1 |
1 |
2702 |
5.9 |
-0.2 |
0.362 |
0 |
0 |
0 |
0.000 |
|