| ## |
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 |
67 |
16 |
8422 |
◊ |
B |
x,x-y,-z |
6_555 |
50 |
14 |
8381 |
576.6 |
0.4 |
0.554 |
9 |
1 |
0 |
0.000 |
2 |
|
C |
60 |
15 |
8397 |
◊ |
A |
-y,-x,-z-1/3 |
4_554 |
48 |
16 |
8461 |
492.8 |
-0.4 |
0.563 |
8 |
1 |
0 |
0.000 |
| Average: |
534.7 |
-0.0 |
0.558 |
9 |
1 |
0 |
0.000 |
| 2 |
3 |
|
B |
60 |
18 |
8381 |
◊ |
A |
x,y,z |
1_555 |
59 |
18 |
8461 |
478.7 |
-0.1 |
0.596 |
1 |
0 |
0 |
0.000 |
| 3 |
4 |
|
C |
54 |
15 |
8397 |
◊ |
B |
-y,-x,-z-1/3 |
4_554 |
51 |
13 |
8381 |
467.9 |
0.0 |
0.520 |
5 |
5 |
0 |
0.000 |
5 |
|
D |
56 |
17 |
8422 |
◊ |
A |
x,x-y,-z |
6_555 |
56 |
16 |
8461 |
463.1 |
0.5 |
0.537 |
7 |
3 |
0 |
0.000 |
| Average: |
465.5 |
0.3 |
0.528 |
6 |
4 |
0 |
0.000 |
| 4 |
6 |
|
[GCP]B:202 |
31 |
1 |
646 |
f |
B |
x,y,z |
1_555 |
69 |
23 |
8381 |
445.1 |
-4.4 |
0.432 |
14 |
0 |
0 |
0.053 |
7 |
|
[GCP]A:202 |
30 |
1 |
644 |
f |
A |
x,y,z |
1_555 |
67 |
22 |
8461 |
444.8 |
-4.5 |
0.441 |
16 |
0 |
0 |
0.053 |
8 |
|
[GCP]C:202 |
30 |
1 |
650 |
f |
C |
x,y,z |
1_555 |
68 |
24 |
8397 |
444.1 |
-4.5 |
0.438 |
17 |
0 |
0 |
0.053 |
9 |
|
[GCP]D:202 |
30 |
1 |
640 |
f |
D |
x,y,z |
1_555 |
67 |
23 |
8422 |
440.3 |
-4.3 |
0.423 |
17 |
0 |
0 |
0.053 |
| Average: |
443.6 |
-4.4 |
0.434 |
16 |
0 |
0 |
0.053 |
| 5 |
10 |
|
[R6W]A:203 |
41 |
1 |
1003 |
f |
D |
x,y,z |
1_555 |
58 |
17 |
8422 |
420.8 |
-2.3 |
0.299 |
6 |
0 |
0 |
0.019 |
11 |
|
[R6W]C:203 |
41 |
1 |
1005 |
f |
C |
x,y,z |
1_555 |
59 |
17 |
8397 |
419.0 |
-2.0 |
0.327 |
7 |
0 |
0 |
0.019 |
| Average: |
419.9 |
-2.2 |
0.313 |
7 |
0 |
0 |
0.019 |
| 6 |
12 |
|
[R6W]C:203 |
42 |
1 |
1005 |
◊ |
B |
x,y,z |
1_555 |
53 |
17 |
8381 |
412.6 |
-1.6 |
0.312 |
6 |
0 |
0 |
0.000 |
13 |
|
[R6W]A:203 |
41 |
1 |
1003 |
◊ |
A |
x,y,z |
1_555 |
52 |
17 |
8461 |
409.4 |
-1.4 |
0.336 |
5 |
0 |
0 |
0.000 |
| Average: |
411.0 |
-1.5 |
0.324 |
6 |
0 |
0 |
0.000 |
| 7 |
14 |
|
D |
43 |
11 |
8422 |
◊ |
D |
x,x-y+1,-z |
6_565 |
43 |
11 |
8422 |
370.8 |
-0.7 |
0.514 |
2 |
4 |
0 |
0.000 |
| 8 |
15 |
|
A |
40 |
9 |
8461 |
◊ |
C |
x-1,y,z |
1_455 |
38 |
10 |
8397 |
330.4 |
-0.1 |
0.593 |
4 |
1 |
0 |
0.000 |
16 |
|
D |
33 |
11 |
8422 |
◊ |
B |
x-1,y,z |
1_455 |
34 |
9 |
8381 |
281.8 |
0.4 |
0.566 |
4 |
1 |
0 |
0.000 |
| Average: |
306.1 |
0.2 |
0.580 |
4 |
1 |
0 |
0.000 |
| 9 |
17 |
|
C |
35 |
11 |
8397 |
◊ |
C |
-y+1,-x+1,-z-1/3 |
4_664 |
35 |
11 |
8397 |
268.9 |
1.1 |
0.717 |
4 |
0 |
0 |
0.000 |
| 10 |
18 |
|
C |
25 |
8 |
8397 |
◊ |
B |
x,y,z |
1_555 |
26 |
10 |
8381 |
240.8 |
-1.0 |
0.441 |
2 |
4 |
0 |
0.000 |
19 |
|
D |
24 |
9 |
8422 |
◊ |
A |
x,y,z |
1_555 |
25 |
9 |
8461 |
232.5 |
-0.3 |
0.551 |
2 |
4 |
0 |
0.000 |
| Average: |
236.6 |
-0.7 |
0.496 |
2 |
4 |
0 |
0.000 |
| 11 |
20 |
|
C |
17 |
6 |
8397 |
◊ |
C |
-y,-x,-z-1/3 |
4_554 |
18 |
6 |
8397 |
156.0 |
3.0 |
0.910 |
0 |
4 |
0 |
0.000 |
21 |
|
D |
13 |
4 |
8422 |
◊ |
D |
x,x-y,-z |
6_555 |
13 |
4 |
8422 |
122.7 |
2.8 |
0.915 |
0 |
4 |
0 |
0.000 |
| Average: |
139.3 |
2.9 |
0.913 |
0 |
4 |
0 |
0.000 |
| 12 |
22 |
|
A |
12 |
5 |
8461 |
◊ |
B |
x-1,y,z |
1_455 |
11 |
5 |
8381 |
142.2 |
-2.5 |
0.092 |
1 |
0 |
0 |
0.000 |
| 13 |
23 |
|
A |
9 |
3 |
8461 |
◊ |
C |
-y,-x+1,-z-1/3 |
4_564 |
7 |
2 |
8397 |
62.7 |
0.5 |
0.689 |
0 |
0 |
0 |
0.000 |
| 14 |
24 |
|
[MG]C:201 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
8397 |
39.8 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.027 |
25 |
|
[MG]A:201 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
11 |
5 |
8461 |
39.5 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.027 |
26 |
|
[MG]D:201 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
8422 |
39.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.027 |
27 |
|
[MG]B:201 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
8381 |
39.4 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.027 |
| Average: |
39.5 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.027 |
| 15 |
28 |
|
D |
3 |
1 |
8422 |
◊ |
B |
x-1,x-y,-z |
6_455 |
6 |
2 |
8381 |
38.8 |
1.6 |
0.823 |
1 |
2 |
0 |
0.000 |
| 16 |
29 |
|
[GCP]C:202 |
4 |
1 |
650 |
f |
[MG]C:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.6 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.022 |
30 |
|
[GCP]A:202 |
5 |
1 |
644 |
f |
[MG]A:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.022 |
31 |
|
[GCP]B:202 |
4 |
1 |
646 |
f |
[MG]B:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.4 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.022 |
32 |
|
[GCP]D:202 |
4 |
1 |
640 |
f |
[MG]D:201 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.1 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.022 |
| Average: |
34.4 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.022 |
| 17 |
33 |
|
[GCP]D:202 |
4 |
1 |
640 |
◊ |
A |
x,x-y,-z |
6_555 |
4 |
2 |
8461 |
28.9 |
0.3 |
0.594 |
0 |
0 |
0 |
0.000 |
34 |
|
[GCP]C:202 |
3 |
1 |
650 |
◊ |
B |
-y,-x,-z-1/3 |
4_554 |
3 |
2 |
8381 |
14.8 |
0.3 |
0.589 |
0 |
0 |
0 |
0.000 |
| Average: |
21.8 |
0.3 |
0.592 |
0 |
0 |
0 |
0.000 |
| 18 |
35 |
|
[R6W]A:203 |
6 |
1 |
1003 |
◊ |
D |
x,x-y,-z |
6_555 |
4 |
2 |
8422 |
24.9 |
0.8 |
0.692 |
0 |
0 |
0 |
0.000 |
36 |
|
[R6W]C:203 |
6 |
1 |
1005 |
◊ |
C |
-y,-x,-z-1/3 |
4_554 |
3 |
2 |
8397 |
24.8 |
0.7 |
0.674 |
0 |
0 |
0 |
0.000 |
| Average: |
24.9 |
0.7 |
0.683 |
0 |
0 |
0 |
0.000 |
| 19 |
37 |
|
B |
3 |
1 |
8381 |
◊ |
B |
x,x-y,-z |
6_555 |
3 |
1 |
8381 |
23.4 |
0.3 |
0.694 |
0 |
0 |
0 |
0.000 |
| 20 |
38 |
|
[GCP]B:202 |
1 |
1 |
646 |
◊ |
D |
x,x-y,-z |
6_555 |
2 |
1 |
8422 |
7.2 |
0.0 |
0.469 |
0 |
0 |
0 |
0.000 |
39 |
|
[GCP]A:202 |
1 |
1 |
644 |
◊ |
C |
-y,-x,-z-1/3 |
4_554 |
2 |
1 |
8397 |
6.0 |
0.1 |
0.537 |
0 |
0 |
0 |
0.000 |
| Average: |
6.6 |
0.1 |
0.503 |
0 |
0 |
0 |
0.000 |
| 21 |
40 |
|
A |
1 |
1 |
8461 |
◊ |
A |
-y,-x,-z-1/3 |
4_554 |
1 |
1 |
8461 |
2.3 |
0.1 |
0.724 |
0 |
0 |
0 |
0.000 |
|