| ## |
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 |
|
J |
124 |
30 |
9824 |
◊ |
I |
x,y,z |
1_555 |
128 |
30 |
9502 |
1305.1 |
-11.8 |
0.303 |
20 |
5 |
0 |
1.000 |
2 |
|
D |
121 |
32 |
9584 |
◊ |
C |
x,y,z |
1_555 |
124 |
31 |
9368 |
1294.4 |
-9.9 |
0.340 |
22 |
8 |
0 |
1.000 |
3 |
|
L |
126 |
32 |
9595 |
◊ |
K |
x,y,z |
1_555 |
119 |
32 |
9596 |
1293.5 |
-9.4 |
0.376 |
23 |
10 |
0 |
1.000 |
4 |
|
B |
123 |
31 |
9652 |
◊ |
A |
x,y,z |
1_555 |
130 |
31 |
9769 |
1292.4 |
-9.6 |
0.371 |
22 |
10 |
0 |
1.000 |
5 |
|
F |
120 |
30 |
9613 |
◊ |
E |
x,y,z |
1_555 |
127 |
33 |
9548 |
1272.8 |
-11.9 |
0.268 |
21 |
10 |
0 |
1.000 |
6 |
|
H |
132 |
33 |
9429 |
◊ |
G |
x,y,z |
1_555 |
125 |
30 |
9853 |
1262.7 |
-10.0 |
0.388 |
16 |
8 |
0 |
1.000 |
| Average: |
1286.8 |
-10.4 |
0.341 |
21 |
9 |
0 |
1.000 |
| 2 |
7 |
|
E |
50 |
13 |
9548 |
◊ |
C |
x,y,z |
1_555 |
50 |
13 |
9368 |
527.1 |
-3.1 |
0.449 |
1 |
2 |
0 |
0.155 |
8 |
|
L |
56 |
13 |
9595 |
◊ |
G |
x,y,z |
1_555 |
54 |
14 |
9853 |
507.8 |
-5.0 |
0.366 |
1 |
1 |
0 |
0.155 |
9 |
|
F |
52 |
13 |
9613 |
◊ |
A |
x,y,z |
1_555 |
49 |
13 |
9769 |
487.4 |
-4.4 |
0.389 |
1 |
2 |
0 |
0.155 |
10 |
|
D |
53 |
12 |
9584 |
◊ |
B |
x,y,z |
1_555 |
47 |
12 |
9652 |
486.9 |
-3.7 |
0.449 |
0 |
1 |
0 |
0.155 |
11 |
|
J |
44 |
10 |
9824 |
◊ |
H |
x,y,z |
1_555 |
47 |
13 |
9429 |
431.7 |
-4.9 |
0.310 |
0 |
0 |
0 |
0.155 |
12 |
|
K |
40 |
12 |
9596 |
◊ |
I |
x,y,z |
1_555 |
41 |
11 |
9502 |
409.7 |
-5.4 |
0.235 |
2 |
0 |
0 |
0.155 |
| Average: |
475.1 |
-4.4 |
0.366 |
1 |
1 |
0 |
0.155 |
| 3 |
13 |
|
E |
58 |
17 |
9548 |
◊ |
E |
-x,y,-z-1/2 |
3_554 |
59 |
17 |
9548 |
513.2 |
1.4 |
0.811 |
2 |
0 |
0 |
0.000 |
| 4 |
14 |
|
E |
47 |
13 |
9548 |
◊ |
A |
x,y,z |
1_555 |
51 |
17 |
9769 |
510.5 |
-5.0 |
0.323 |
1 |
2 |
0 |
0.195 |
15 |
|
K |
48 |
14 |
9596 |
◊ |
G |
x,y,z |
1_555 |
52 |
18 |
9853 |
504.4 |
-6.3 |
0.264 |
2 |
2 |
0 |
0.195 |
16 |
|
K |
48 |
17 |
9596 |
◊ |
J |
x,y,z |
1_555 |
50 |
13 |
9824 |
503.2 |
-5.0 |
0.327 |
2 |
1 |
0 |
0.195 |
17 |
|
E |
44 |
16 |
9548 |
◊ |
D |
x,y,z |
1_555 |
51 |
12 |
9584 |
471.5 |
-6.5 |
0.213 |
0 |
1 |
0 |
0.195 |
18 |
|
D |
43 |
14 |
9584 |
◊ |
A |
x,y,z |
1_555 |
46 |
13 |
9769 |
465.7 |
-5.2 |
0.281 |
2 |
1 |
0 |
0.195 |
19 |
|
J |
40 |
14 |
9824 |
◊ |
G |
x,y,z |
1_555 |
48 |
14 |
9853 |
456.3 |
-6.6 |
0.199 |
2 |
1 |
0 |
0.195 |
| Average: |
485.3 |
-5.8 |
0.268 |
2 |
1 |
0 |
0.195 |
| 5 |
20 |
|
L |
39 |
10 |
9595 |
◊ |
K |
x,-y,-z |
4_555 |
29 |
11 |
9596 |
338.4 |
-2.7 |
0.394 |
2 |
0 |
0 |
0.120 |
21 |
|
G |
34 |
11 |
9853 |
◊ |
B |
x,y,z |
1_555 |
33 |
8 |
9652 |
329.9 |
-4.3 |
0.285 |
3 |
0 |
0 |
0.120 |
22 |
|
H |
32 |
10 |
9429 |
◊ |
A |
x,y,z |
1_555 |
34 |
11 |
9769 |
324.0 |
-5.1 |
0.207 |
1 |
0 |
0 |
0.120 |
23 |
|
I |
31 |
9 |
9502 |
◊ |
D |
x,-y,-z |
4_555 |
34 |
10 |
9584 |
306.0 |
-4.7 |
0.248 |
1 |
0 |
0 |
0.120 |
24 |
|
J |
31 |
10 |
9824 |
◊ |
C |
x,-y,-z |
4_555 |
36 |
9 |
9368 |
305.9 |
-4.3 |
0.281 |
0 |
0 |
0 |
0.120 |
25 |
|
F |
30 |
8 |
9613 |
◊ |
E |
x,-y,-z |
4_555 |
29 |
9 |
9548 |
293.2 |
-5.0 |
0.189 |
0 |
0 |
0 |
0.120 |
| Average: |
316.2 |
-4.3 |
0.267 |
1 |
0 |
0 |
0.120 |
| 6 |
26 |
|
L |
37 |
10 |
9595 |
◊ |
L |
-x-1,y,-z-1/2 |
3_454 |
36 |
10 |
9595 |
293.5 |
-2.5 |
0.467 |
0 |
0 |
0 |
0.000 |
| 7 |
27 |
|
I |
32 |
9 |
9502 |
◊ |
I |
-x-1,y,-z+1/2 |
3_455 |
32 |
9 |
9502 |
287.6 |
1.0 |
0.785 |
2 |
4 |
0 |
0.000 |
| 8 |
28 |
|
H |
31 |
10 |
9429 |
◊ |
D |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
28 |
8 |
9584 |
272.3 |
2.1 |
0.838 |
1 |
2 |
0 |
0.000 |
| 9 |
29 |
|
H |
29 |
7 |
9429 |
◊ |
C |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
32 |
9 |
9368 |
265.1 |
-2.5 |
0.424 |
1 |
0 |
0 |
0.000 |
| 10 |
30 |
|
K |
17 |
4 |
9596 |
◊ |
C |
x-1/2,y-1/2,z |
5_445 |
22 |
6 |
9368 |
143.2 |
-0.1 |
0.650 |
0 |
0 |
0 |
0.000 |
| 11 |
31 |
|
L |
17 |
6 |
9595 |
◊ |
B |
-x-1,y,-z-1/2 |
3_454 |
16 |
7 |
9652 |
111.7 |
-0.2 |
0.634 |
0 |
0 |
0 |
0.000 |
| 12 |
32 |
|
H |
15 |
5 |
9429 |
◊ |
B |
x,y,z |
1_555 |
14 |
6 |
9652 |
111.0 |
-0.2 |
0.636 |
1 |
0 |
0 |
0.001 |
33 |
|
L |
12 |
4 |
9595 |
◊ |
L |
x,-y,-z |
4_555 |
12 |
4 |
9595 |
84.8 |
0.4 |
0.710 |
0 |
0 |
0 |
0.001 |
34 |
|
I |
7 |
3 |
9502 |
◊ |
C |
x,-y,-z |
4_555 |
6 |
4 |
9368 |
52.0 |
0.2 |
0.674 |
0 |
0 |
0 |
0.001 |
35 |
|
F |
6 |
4 |
9613 |
◊ |
F |
x,-y,-z |
4_555 |
6 |
4 |
9613 |
51.0 |
0.1 |
0.669 |
0 |
0 |
0 |
0.001 |
| Average: |
74.7 |
0.1 |
0.672 |
0 |
0 |
0 |
0.001 |
| 13 |
36 |
|
J |
10 |
4 |
9824 |
◊ |
F |
x-1/2,-y-1/2,-z |
8_445 |
7 |
4 |
9613 |
64.9 |
0.6 |
0.730 |
0 |
0 |
0 |
0.000 |
| 14 |
37 |
|
H |
7 |
2 |
9429 |
◊ |
I |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
9 |
4 |
9502 |
64.0 |
0.2 |
0.699 |
0 |
1 |
0 |
0.000 |
| 15 |
38 |
|
[MG]I:201 |
1 |
1 |
98 |
f |
I |
x,y,z |
1_555 |
5 |
4 |
9502 |
50.9 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.315 |
39 |
|
[MG]F:201 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
5 |
5 |
9613 |
49.3 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.315 |
| Average: |
50.1 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.315 |
| 16 |
40 |
|
B |
6 |
2 |
9652 |
◊ |
C |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
5 |
3 |
9368 |
50.1 |
0.8 |
0.778 |
1 |
2 |
0 |
0.000 |
| 17 |
41 |
|
E |
3 |
2 |
9548 |
◊ |
D |
-x,y,-z-1/2 |
3_554 |
8 |
3 |
9584 |
37.6 |
0.7 |
0.799 |
0 |
0 |
0 |
0.000 |
| 18 |
42 |
|
G |
2 |
1 |
9853 |
◊ |
D |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
6 |
2 |
9584 |
32.4 |
0.7 |
0.746 |
0 |
0 |
0 |
0.000 |
| 19 |
43 |
|
G |
4 |
1 |
9853 |
◊ |
C |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
4 |
2 |
9368 |
27.8 |
0.3 |
0.543 |
0 |
0 |
0 |
0.000 |
| 20 |
44 |
|
A |
4 |
1 |
9769 |
◊ |
J |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
4 |
1 |
9824 |
27.8 |
-0.1 |
0.583 |
0 |
0 |
0 |
0.000 |
| 21 |
45 |
|
A |
3 |
3 |
9769 |
◊ |
I |
-x-1/2,-y-1/2,z-1/2 |
6_444 |
3 |
2 |
9502 |
9.0 |
0.2 |
0.720 |
0 |
0 |
0 |
0.000 |
| 22 |
46 |
|
G |
1 |
1 |
9853 |
◊ |
F |
x-1/2,-y-1/2,-z |
8_445 |
1 |
1 |
9613 |
1.5 |
0.0 |
0.755 |
0 |
0 |
0 |
0.000 |
|