## |
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 |
105 |
31 |
10048 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
110 |
32 |
10002 |
1097.5 |
2.5 |
0.912 |
23 |
12 |
0 |
0.000 |
2 |
2 |
|
D |
92 |
32 |
10048 |
◊ |
C |
x,y,z |
1_555 |
103 |
36 |
9992 |
964.2 |
-11.7 |
0.208 |
13 |
7 |
0 |
0.315 |
3 |
|
B |
82 |
29 |
10002 |
◊ |
A |
x,y,z |
1_555 |
86 |
30 |
9749 |
805.7 |
-8.3 |
0.326 |
13 |
8 |
0 |
0.315 |
Average: |
885.0 |
-10.0 |
0.267 |
13 |
8 |
0 |
0.315 |
3 |
4 |
|
[ADP]D:302 |
27 |
1 |
549 |
f |
D |
x,y,z |
1_555 |
49 |
22 |
10048 |
346.0 |
-5.3 |
0.611 |
13 |
0 |
0 |
0.373 |
5 |
|
[ADP]B:302 |
27 |
1 |
548 |
f |
B |
x,y,z |
1_555 |
47 |
20 |
10002 |
345.8 |
-6.6 |
0.550 |
11 |
0 |
0 |
0.373 |
6 |
|
[ADP]A:302 |
27 |
1 |
553 |
f |
A |
x,y,z |
1_555 |
46 |
18 |
9749 |
340.8 |
-6.3 |
0.576 |
9 |
0 |
0 |
0.373 |
Average: |
344.2 |
-6.1 |
0.579 |
11 |
0 |
0 |
0.373 |
4 |
7 |
|
B |
37 |
12 |
10002 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
33 |
9 |
9992 |
334.7 |
-1.6 |
0.538 |
4 |
6 |
0 |
0.000 |
5 |
8 |
|
D |
38 |
11 |
10048 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
35 |
12 |
9749 |
329.5 |
0.5 |
0.799 |
4 |
3 |
0 |
0.000 |
6 |
9 |
|
[ADP]C:302 |
25 |
1 |
516 |
f |
C |
x,y,z |
1_555 |
36 |
15 |
9992 |
258.1 |
-3.6 |
0.647 |
9 |
0 |
0 |
0.130 |
7 |
10 |
|
A |
30 |
10 |
9749 |
x |
A |
x-1/2,-y-1/2,-z |
4_445 |
21 |
6 |
9749 |
255.1 |
2.8 |
0.909 |
5 |
4 |
0 |
0.000 |
8 |
11 |
|
C |
26 |
10 |
9992 |
◊ |
B |
x-1,y,z |
1_455 |
26 |
9 |
10002 |
238.7 |
-1.8 |
0.474 |
1 |
0 |
0 |
0.000 |
9 |
12 |
|
C |
17 |
7 |
9992 |
◊ |
A |
x,y,z |
1_555 |
20 |
9 |
9749 |
132.6 |
-2.8 |
0.285 |
0 |
0 |
0 |
0.000 |
10 |
13 |
|
C |
9 |
4 |
9992 |
◊ |
B |
x,y,z |
1_555 |
18 |
7 |
10002 |
119.3 |
2.1 |
0.829 |
1 |
2 |
0 |
0.000 |
11 |
14 |
|
[ADP]C:302 |
13 |
1 |
516 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
10048 |
69.2 |
0.4 |
0.418 |
1 |
0 |
0 |
0.000 |
12 |
15 |
|
B |
8 |
4 |
10002 |
x |
B |
x-1,y,z |
1_455 |
6 |
2 |
10002 |
67.4 |
1.6 |
0.841 |
3 |
1 |
0 |
0.000 |
13 |
16 |
|
B |
6 |
3 |
10002 |
◊ |
C |
-x-1,y-1/2,-z+1/2 |
3_445 |
10 |
4 |
9992 |
62.4 |
0.2 |
0.639 |
1 |
2 |
0 |
0.000 |
14 |
17 |
|
[ADP]D:302 |
9 |
1 |
549 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
9992 |
57.1 |
0.5 |
0.448 |
0 |
0 |
0 |
0.000 |
15 |
18 |
|
[ADP]B:302 |
9 |
1 |
548 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
9749 |
56.7 |
0.4 |
0.392 |
0 |
0 |
0 |
0.000 |
19 |
|
[ADP]A:302 |
9 |
1 |
553 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
10002 |
52.5 |
0.4 |
0.398 |
0 |
0 |
0 |
0.000 |
Average: |
54.6 |
0.4 |
0.395 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
D |
6 |
2 |
10048 |
x |
D |
x-1/2,-y+1/2,-z |
4_455 |
8 |
2 |
10048 |
49.9 |
-0.7 |
0.457 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[MG]D:301 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
12 |
5 |
10048 |
38.0 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.188 |
22 |
|
[MG]C:301 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
9992 |
38.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.188 |
23 |
|
[MG]A:301 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
9749 |
37.7 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.188 |
24 |
|
[MG]B:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
12 |
5 |
10002 |
37.2 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.188 |
Average: |
37.7 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.188 |
18 |
25 |
|
[ADP]A:302 |
4 |
1 |
553 |
f |
[MG]A:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.9 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.192 |
26 |
|
[ADP]B:302 |
4 |
1 |
548 |
f |
[MG]B:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.8 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.192 |
27 |
|
[ADP]D:302 |
4 |
1 |
549 |
f |
[MG]D:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.6 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.192 |
28 |
|
[ADP]C:302 |
4 |
1 |
516 |
f |
[MG]C:301 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.2 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.192 |
Average: |
34.6 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.192 |
19 |
29 |
|
B |
4 |
2 |
10002 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
2 |
2 |
10048 |
33.9 |
-0.6 |
0.247 |
0 |
0 |
0 |
0.000 |
20 |
30 |
|
A |
1 |
1 |
9749 |
◊ |
C |
-x-1,y-1/2,-z+1/2 |
3_445 |
1 |
1 |
9992 |
10.8 |
-0.3 |
0.181 |
0 |
0 |
0 |
0.000 |
21 |
31 |
|
D |
1 |
1 |
10048 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
10002 |
2.0 |
-0.0 |
0.551 |
0 |
0 |
0 |
0.000 |
22 |
32 |
|
C |
1 |
1 |
9992 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
10048 |
0.5 |
-0.0 |
0.602 |
0 |
0 |
0 |
0.000 |
|