| ## |
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 |
95 |
26 |
8402 |
◊ |
A |
x,y,z |
1_555 |
88 |
25 |
8523 |
803.5 |
-2.1 |
0.670 |
6 |
0 |
0 |
0.000 |
2 |
|
D |
95 |
25 |
8527 |
◊ |
C |
-x+1/2,y-1/2,-z-1 |
4_544 |
94 |
25 |
8407 |
797.7 |
-1.7 |
0.693 |
8 |
0 |
0 |
0.000 |
| Average: |
800.6 |
-1.9 |
0.681 |
7 |
0 |
0 |
0.000 |
| 2 |
3 |
|
[NDP]A:163 |
47 |
1 |
934 |
f |
A |
x,y,z |
1_555 |
84 |
31 |
8523 |
582.0 |
-3.3 |
0.509 |
26 |
0 |
0 |
0.086 |
4 |
|
[NDP]C:163 |
47 |
1 |
934 |
f |
C |
x,y,z |
1_555 |
84 |
31 |
8407 |
576.0 |
-3.1 |
0.540 |
29 |
0 |
0 |
0.086 |
5 |
|
[NDP]D:163 |
48 |
1 |
931 |
f |
D |
x,y,z |
1_555 |
86 |
32 |
8527 |
574.9 |
-2.8 |
0.555 |
29 |
0 |
0 |
0.086 |
6 |
|
[NDP]B:163 |
48 |
1 |
930 |
f |
B |
x,y,z |
1_555 |
85 |
31 |
8402 |
570.9 |
-2.4 |
0.586 |
28 |
0 |
0 |
0.086 |
| Average: |
576.0 |
-2.9 |
0.547 |
28 |
0 |
0 |
0.086 |
| 3 |
7 |
|
C |
56 |
20 |
8407 |
◊ |
A |
x,y,z |
1_555 |
59 |
21 |
8523 |
527.0 |
-7.8 |
0.143 |
3 |
0 |
0 |
0.000 |
8 |
|
B |
54 |
21 |
8402 |
◊ |
D |
x-1/2,y-1/2,z |
3_445 |
53 |
19 |
8527 |
480.9 |
-7.8 |
0.127 |
3 |
0 |
0 |
0.000 |
| Average: |
503.9 |
-7.8 |
0.135 |
3 |
0 |
0 |
0.000 |
| 4 |
9 |
|
B |
55 |
16 |
8402 |
◊ |
A |
x,y-1,z |
1_545 |
52 |
14 |
8523 |
486.2 |
-5.8 |
0.251 |
4 |
1 |
0 |
0.000 |
10 |
|
C |
51 |
15 |
8407 |
◊ |
D |
-x+1/2,y-1/2,-z-1 |
4_544 |
55 |
16 |
8527 |
470.5 |
-6.8 |
0.173 |
4 |
1 |
0 |
0.000 |
| Average: |
478.3 |
-6.3 |
0.212 |
4 |
1 |
0 |
0.000 |
| 5 |
11 |
|
[MTX]B:164 |
33 |
1 |
677 |
f |
B |
x,y,z |
1_555 |
58 |
21 |
8402 |
453.8 |
-0.5 |
0.352 |
10 |
0 |
0 |
0.026 |
12 |
|
[MTX]D:164 |
33 |
1 |
673 |
f |
D |
x,y,z |
1_555 |
55 |
19 |
8527 |
452.2 |
-0.2 |
0.347 |
10 |
0 |
0 |
0.026 |
13 |
|
[MTX]A:164 |
33 |
1 |
677 |
f |
A |
x,y,z |
1_555 |
53 |
20 |
8523 |
451.3 |
-0.3 |
0.343 |
11 |
0 |
0 |
0.026 |
14 |
|
[MTX]C:164 |
32 |
1 |
676 |
f |
C |
x,y,z |
1_555 |
54 |
21 |
8407 |
449.3 |
1.4 |
0.494 |
10 |
0 |
0 |
0.026 |
| Average: |
451.7 |
0.1 |
0.384 |
10 |
0 |
0 |
0.026 |
| 6 |
15 |
|
B |
39 |
12 |
8402 |
◊ |
A |
-x+1/2,y-1/2,-z |
4_545 |
38 |
13 |
8523 |
340.6 |
2.9 |
0.890 |
5 |
5 |
0 |
0.000 |
| 7 |
16 |
|
C |
29 |
10 |
8407 |
x |
C |
-x+1/2,y-1/2,-z-1 |
4_544 |
28 |
11 |
8407 |
266.1 |
-0.7 |
0.580 |
3 |
4 |
0 |
0.000 |
| 8 |
17 |
|
B |
24 |
8 |
8402 |
◊ |
D |
-x+1/2,y-1/2,-z |
4_545 |
31 |
9 |
8527 |
249.0 |
-0.6 |
0.495 |
5 |
2 |
0 |
0.000 |
| 9 |
18 |
|
D |
19 |
7 |
8527 |
◊ |
D |
-x+1,y,-z |
2_655 |
19 |
7 |
8527 |
162.5 |
0.9 |
0.765 |
2 |
0 |
0 |
0.000 |
| 10 |
19 |
|
A |
13 |
3 |
8523 |
◊ |
C |
-x+1/2,y-1/2,-z-1 |
4_544 |
17 |
7 |
8407 |
105.5 |
0.5 |
0.713 |
0 |
0 |
0 |
0.000 |
| 11 |
20 |
|
[NDP]B:163 |
11 |
1 |
930 |
◊ |
A |
x,y,z |
1_555 |
11 |
4 |
8523 |
79.9 |
-0.4 |
0.441 |
0 |
0 |
0 |
0.000 |
21 |
|
D |
10 |
5 |
8527 |
◊ |
[NDP]C:163 |
-x+1/2,y-1/2,-z-1 |
4_544 |
11 |
1 |
934 |
76.7 |
-0.0 |
0.586 |
2 |
0 |
0 |
0.000 |
22 |
|
[NDP]D:163 |
12 |
1 |
931 |
◊ |
C |
-x+1/2,y-1/2,-z-1 |
4_544 |
14 |
6 |
8407 |
76.7 |
0.9 |
0.713 |
2 |
0 |
0 |
0.000 |
23 |
|
[NDP]A:163 |
11 |
1 |
934 |
◊ |
B |
x,y,z |
1_555 |
9 |
5 |
8402 |
71.0 |
-0.0 |
0.597 |
2 |
0 |
0 |
0.000 |
| Average: |
76.1 |
0.1 |
0.584 |
2 |
0 |
0 |
0.000 |
| 12 |
24 |
|
[NDP]D:163 |
12 |
1 |
931 |
◊ |
[NDP]C:163 |
-x+1/2,y-1/2,-z-1 |
4_544 |
12 |
1 |
934 |
73.7 |
-0.7 |
0.489 |
0 |
0 |
0 |
0.000 |
25 |
|
[NDP]B:163 |
12 |
1 |
930 |
◊ |
[NDP]A:163 |
x,y,z |
1_555 |
12 |
1 |
934 |
72.1 |
-0.7 |
0.491 |
0 |
0 |
0 |
0.000 |
| Average: |
72.9 |
-0.7 |
0.490 |
0 |
0 |
0 |
0.000 |
| 13 |
26 |
|
[MTX]D:164 |
13 |
1 |
673 |
f |
[NDP]D:163 |
x,y,z |
1_555 |
11 |
1 |
931 |
70.7 |
0.3 |
0.436 |
0 |
0 |
0 |
0.000 |
27 |
|
[MTX]B:164 |
13 |
1 |
677 |
f |
[NDP]B:163 |
x,y,z |
1_555 |
11 |
1 |
930 |
70.0 |
0.3 |
0.431 |
0 |
0 |
0 |
0.000 |
28 |
|
[MTX]C:164 |
13 |
1 |
676 |
f |
[NDP]C:163 |
x,y,z |
1_555 |
10 |
1 |
934 |
69.0 |
0.4 |
0.435 |
0 |
0 |
0 |
0.000 |
29 |
|
[MTX]A:164 |
13 |
1 |
677 |
f |
[NDP]A:163 |
x,y,z |
1_555 |
9 |
1 |
934 |
65.9 |
0.4 |
0.442 |
0 |
0 |
0 |
0.000 |
| Average: |
68.9 |
0.3 |
0.436 |
0 |
0 |
0 |
0.000 |
| 14 |
30 |
|
A |
3 |
1 |
8523 |
x |
A |
x,y-1,z |
1_545 |
1 |
1 |
8523 |
14.4 |
0.3 |
0.779 |
0 |
0 |
0 |
0.000 |
31 |
|
C |
1 |
1 |
8407 |
x |
C |
x,y-1,z |
1_545 |
3 |
1 |
8407 |
12.8 |
0.3 |
0.765 |
0 |
0 |
0 |
0.000 |
32 |
|
B |
4 |
2 |
8402 |
x |
B |
x,y-1,z |
1_545 |
2 |
2 |
8402 |
10.5 |
0.1 |
0.681 |
0 |
0 |
0 |
0.000 |
33 |
|
D |
1 |
1 |
8527 |
x |
D |
x,y-1,z |
1_545 |
1 |
1 |
8527 |
3.9 |
0.1 |
0.766 |
0 |
0 |
0 |
0.000 |
| Average: |
10.4 |
0.2 |
0.748 |
0 |
0 |
0 |
0.000 |
| 15 |
34 |
|
D |
5 |
2 |
8527 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
8523 |
13.8 |
-0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
|