## |
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 |
407 |
112 |
18110 |
◊ |
C |
x,y,z |
1_555 |
399 |
112 |
18273 |
3878.2 |
-55.0 |
0.030 |
62 |
4 |
0 |
0.745 |
2 |
|
B |
400 |
113 |
18456 |
◊ |
A |
x,y,z |
1_555 |
404 |
113 |
19124 |
3863.0 |
-52.8 |
0.033 |
60 |
7 |
0 |
0.745 |
Average: |
3870.6 |
-53.9 |
0.031 |
61 |
6 |
0 |
0.745 |
2 |
3 |
|
C |
123 |
39 |
18273 |
◊ |
B |
x,y,z |
1_555 |
127 |
40 |
18456 |
1202.3 |
-17.0 |
0.115 |
19 |
8 |
0 |
0.558 |
4 |
|
D |
122 |
40 |
18110 |
◊ |
A |
x,y,z |
1_555 |
122 |
39 |
19124 |
1199.0 |
-16.3 |
0.124 |
19 |
11 |
0 |
0.558 |
Average: |
1200.7 |
-16.7 |
0.120 |
19 |
10 |
0 |
0.558 |
3 |
5 |
|
D |
63 |
23 |
18110 |
◊ |
B |
x,y,z |
1_555 |
63 |
23 |
18456 |
614.6 |
-12.7 |
0.040 |
3 |
0 |
0 |
0.533 |
6 |
|
C |
56 |
20 |
18273 |
◊ |
A |
x,y,z |
1_555 |
59 |
21 |
19124 |
594.7 |
-12.9 |
0.025 |
4 |
0 |
0 |
0.533 |
Average: |
604.7 |
-12.8 |
0.033 |
4 |
0 |
0 |
0.533 |
4 |
7 |
|
[ADP]B:104 |
26 |
1 |
558 |
f |
B |
x,y,z |
1_555 |
46 |
19 |
18456 |
335.5 |
-5.6 |
0.545 |
6 |
0 |
0 |
0.173 |
5 |
8 |
|
[ADP]D:105 |
25 |
1 |
563 |
f |
D |
x,y,z |
1_555 |
45 |
19 |
18110 |
333.1 |
-5.7 |
0.568 |
7 |
0 |
0 |
0.174 |
6 |
9 |
|
D |
31 |
8 |
18110 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
34 |
13 |
18456 |
308.0 |
0.6 |
0.781 |
8 |
2 |
0 |
0.000 |
7 |
10 |
|
[SIM]C:1 |
26 |
1 |
634 |
f |
D |
x,y,z |
1_555 |
29 |
12 |
18110 |
299.6 |
-3.3 |
0.436 |
3 |
0 |
0 |
0.346 |
11 |
|
[SIM]C:2 |
26 |
1 |
638 |
f |
C |
x,y,z |
1_555 |
30 |
12 |
18273 |
297.5 |
-3.7 |
0.406 |
3 |
0 |
0 |
0.346 |
12 |
|
[SIM]B:3 |
26 |
1 |
634 |
f |
B |
x,y,z |
1_555 |
32 |
14 |
18456 |
295.4 |
-3.7 |
0.425 |
3 |
0 |
0 |
0.346 |
13 |
|
[SIM]A:4 |
25 |
1 |
637 |
f |
A |
x,y,z |
1_555 |
32 |
15 |
19124 |
295.1 |
-3.2 |
0.459 |
3 |
0 |
0 |
0.346 |
Average: |
296.9 |
-3.5 |
0.431 |
3 |
0 |
0 |
0.346 |
8 |
14 |
|
[ADP]A:102 |
22 |
1 |
542 |
f |
A |
x,y,z |
1_555 |
27 |
9 |
19124 |
204.5 |
-2.4 |
0.673 |
2 |
0 |
0 |
0.121 |
9 |
15 |
|
[SIM]B:3 |
14 |
1 |
634 |
◊ |
A |
x,y,z |
1_555 |
23 |
12 |
19124 |
203.2 |
-0.6 |
0.587 |
6 |
0 |
0 |
0.071 |
16 |
|
[SIM]C:2 |
15 |
1 |
638 |
◊ |
D |
x,y,z |
1_555 |
22 |
12 |
18110 |
200.6 |
-0.6 |
0.579 |
7 |
0 |
0 |
0.071 |
17 |
|
[SIM]A:4 |
13 |
1 |
637 |
◊ |
B |
x,y,z |
1_555 |
24 |
12 |
18456 |
196.2 |
-1.4 |
0.552 |
5 |
0 |
0 |
0.071 |
18 |
|
[SIM]C:1 |
13 |
1 |
634 |
◊ |
C |
x,y,z |
1_555 |
23 |
12 |
18273 |
196.0 |
-1.2 |
0.547 |
7 |
0 |
0 |
0.071 |
Average: |
199.0 |
-1.0 |
0.566 |
6 |
0 |
0 |
0.071 |
10 |
19 |
|
[ADP]C:103 |
21 |
1 |
541 |
f |
D |
x,y,z |
1_555 |
28 |
8 |
18110 |
199.7 |
-1.6 |
0.710 |
3 |
0 |
0 |
0.058 |
20 |
|
[ADP]B:101 |
21 |
1 |
520 |
f |
B |
x,y,z |
1_555 |
27 |
9 |
18456 |
186.2 |
-2.3 |
0.576 |
1 |
0 |
0 |
0.058 |
Average: |
192.9 |
-2.0 |
0.643 |
2 |
0 |
0 |
0.058 |
11 |
21 |
|
B |
25 |
7 |
18456 |
◊ |
D |
x,y,z-1 |
1_554 |
21 |
4 |
18110 |
194.0 |
0.6 |
0.783 |
3 |
1 |
0 |
0.000 |
12 |
22 |
|
[ADP]C:103 |
14 |
1 |
541 |
◊ |
C |
x,y,z |
1_555 |
12 |
3 |
18273 |
129.0 |
1.4 |
0.610 |
1 |
0 |
0 |
0.000 |
13 |
23 |
|
[ADP]A:102 |
14 |
1 |
542 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
18456 |
123.9 |
1.8 |
0.668 |
0 |
0 |
0 |
0.000 |
14 |
24 |
|
[ADP]B:101 |
13 |
1 |
520 |
◊ |
A |
x,y,z |
1_555 |
13 |
3 |
19124 |
121.2 |
1.0 |
0.609 |
1 |
0 |
0 |
0.000 |
15 |
25 |
|
D |
17 |
3 |
18110 |
◊ |
B |
x-1,y,z |
1_455 |
10 |
3 |
18456 |
109.8 |
-1.1 |
0.331 |
1 |
0 |
0 |
0.000 |
16 |
26 |
|
C |
7 |
2 |
18273 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
7 |
3 |
19124 |
41.8 |
0.5 |
0.768 |
1 |
2 |
0 |
0.000 |
17 |
27 |
|
C |
2 |
1 |
18273 |
x |
C |
x-1,y,z |
1_455 |
10 |
2 |
18273 |
30.4 |
0.3 |
0.735 |
0 |
0 |
0 |
0.000 |
18 |
28 |
|
D |
4 |
2 |
18110 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
2 |
18273 |
22.8 |
0.3 |
0.656 |
0 |
0 |
0 |
0.000 |
19 |
29 |
|
B |
3 |
2 |
18456 |
◊ |
A |
x-1,y,z-1 |
1_454 |
5 |
2 |
19124 |
22.0 |
0.5 |
0.770 |
0 |
0 |
0 |
0.000 |
20 |
30 |
|
A |
3 |
1 |
19124 |
◊ |
D |
x-1,y,z-1 |
1_454 |
1 |
1 |
18110 |
20.3 |
0.7 |
0.906 |
1 |
1 |
0 |
0.000 |
21 |
31 |
|
D |
3 |
1 |
18110 |
◊ |
A |
-x,y-1/2,-z |
2_545 |
1 |
1 |
19124 |
5.3 |
0.3 |
0.780 |
0 |
0 |
0 |
0.000 |
22 |
32 |
|
[ADP]A:102 |
2 |
1 |
542 |
◊ |
D |
x-1,y,z-1 |
1_454 |
1 |
1 |
18110 |
5.0 |
-0.3 |
0.400 |
0 |
0 |
0 |
0.000 |
23 |
33 |
|
C |
1 |
1 |
18273 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
1 |
1 |
18456 |
0.2 |
-0.0 |
0.616 |
0 |
0 |
0 |
0.000 |
|