| ## |
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 |
|
C |
67 |
19 |
8290 |
◊ |
B |
x,y,z |
1_555 |
58 |
16 |
8259 |
575.6 |
-3.1 |
0.382 |
6 |
4 |
0 |
0.188 |
2 |
|
F |
69 |
17 |
8176 |
◊ |
D |
x,y,z |
1_555 |
56 |
16 |
8253 |
570.3 |
-3.5 |
0.358 |
6 |
4 |
0 |
0.188 |
3 |
|
C |
57 |
17 |
8290 |
◊ |
A |
x,y,z |
1_555 |
67 |
17 |
8283 |
566.4 |
-3.9 |
0.313 |
6 |
5 |
0 |
0.188 |
4 |
|
F |
58 |
17 |
8176 |
◊ |
E |
x,y,z |
1_555 |
65 |
18 |
8205 |
566.0 |
-4.2 |
0.305 |
5 |
4 |
0 |
0.188 |
5 |
|
B |
68 |
18 |
8259 |
◊ |
A |
x,y,z |
1_555 |
57 |
16 |
8283 |
565.5 |
-4.2 |
0.288 |
6 |
4 |
0 |
0.188 |
6 |
|
E |
58 |
16 |
8205 |
◊ |
D |
x,y,z |
1_555 |
66 |
18 |
8253 |
565.2 |
-5.5 |
0.202 |
5 |
5 |
0 |
0.188 |
| Average: |
568.2 |
-4.1 |
0.308 |
6 |
4 |
0 |
0.188 |
| 2 |
7 |
|
E |
63 |
17 |
8205 |
x |
E |
-y+1,x+1,z |
3_665 |
48 |
14 |
8205 |
463.9 |
-0.9 |
0.557 |
8 |
3 |
0 |
0.148 |
8 |
|
C |
61 |
17 |
8290 |
x |
B |
-y+1,x+1,z |
3_665 |
47 |
14 |
8259 |
463.4 |
0.7 |
0.642 |
8 |
3 |
0 |
0.148 |
9 |
|
D |
56 |
16 |
8253 |
x |
C |
x,y,z |
1_555 |
44 |
14 |
8290 |
460.1 |
0.4 |
0.575 |
7 |
4 |
0 |
0.148 |
10 |
|
F |
46 |
13 |
8176 |
x |
B |
x,y,z |
1_555 |
55 |
15 |
8259 |
459.4 |
0.5 |
0.636 |
8 |
4 |
0 |
0.148 |
11 |
|
D |
47 |
14 |
8253 |
x |
F |
-y+1,x+1,z |
3_665 |
57 |
16 |
8176 |
452.9 |
-0.0 |
0.573 |
8 |
4 |
0 |
0.148 |
12 |
|
A |
43 |
14 |
8283 |
x |
A |
-y+1,x+1,z |
3_665 |
52 |
16 |
8283 |
440.0 |
0.0 |
0.566 |
7 |
2 |
0 |
0.148 |
| Average: |
456.6 |
0.1 |
0.591 |
8 |
3 |
0 |
0.148 |
| 3 |
13 |
|
E |
31 |
10 |
8205 |
◊ |
B |
-x+1/2,-y+3/2,z-1/2 |
6_564 |
34 |
10 |
8259 |
336.8 |
-2.7 |
0.297 |
6 |
0 |
0 |
0.000 |
| 4 |
14 |
|
A |
31 |
10 |
8283 |
◊ |
B |
-y+1,x+1,z |
3_665 |
29 |
10 |
8259 |
299.2 |
-0.2 |
0.563 |
3 |
0 |
0 |
0.032 |
15 |
|
F |
30 |
10 |
8176 |
◊ |
C |
x,y,z |
1_555 |
29 |
10 |
8290 |
290.5 |
-1.4 |
0.450 |
2 |
0 |
0 |
0.032 |
16 |
|
D |
30 |
10 |
8253 |
◊ |
E |
-y+1,x+1,z |
3_665 |
29 |
10 |
8205 |
287.7 |
-1.4 |
0.437 |
2 |
0 |
0 |
0.032 |
| Average: |
292.4 |
-1.0 |
0.483 |
2 |
0 |
0 |
0.032 |
| 5 |
17 |
|
C |
20 |
7 |
8290 |
◊ |
C |
-x+1,-y+2,z |
2_675 |
20 |
7 |
8290 |
130.6 |
0.9 |
0.712 |
0 |
0 |
0 |
0.000 |
| 6 |
18 |
|
[MG]C:1011 |
1 |
1 |
98 |
f |
B |
-y+1,x+1,z |
3_665 |
10 |
5 |
8259 |
43.5 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.127 |
| 7 |
19 |
|
[MG]E:1013 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
7 |
3 |
8205 |
42.0 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.269 |
20 |
|
[MG]C:1008 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
3 |
8290 |
41.7 |
-6.5 |
0.000 |
0 |
0 |
0 |
0.269 |
21 |
|
[MG]F:1016 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
7 |
3 |
8176 |
41.4 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.269 |
22 |
|
[MG]D:1010 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
6 |
3 |
8253 |
41.3 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.269 |
23 |
|
[MG]B:1007 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
8259 |
40.7 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.269 |
24 |
|
[MG]A:1001 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
8283 |
37.5 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.269 |
| Average: |
40.8 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.269 |
| 8 |
25 |
|
[MG]C:1009 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
8290 |
41.2 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.239 |
26 |
|
D |
8 |
4 |
8253 |
f |
[MG]F:1012 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
41.1 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.239 |
27 |
|
[MG]F:1005 |
1 |
1 |
98 |
f |
F |
x,y,z |
1_555 |
8 |
4 |
8176 |
40.9 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.239 |
28 |
|
[MG]E:1014 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
8 |
4 |
8205 |
40.9 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.239 |
29 |
|
[MG]B:1004 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
3 |
8259 |
39.8 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.239 |
30 |
|
[MG]A:1002 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
8283 |
37.0 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.239 |
| Average: |
40.2 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.239 |
| 9 |
31 |
|
A |
5 |
3 |
8283 |
◊ |
[MG]B:1006 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
38.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.202 |
32 |
|
[MG]B:1006 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
8259 |
38.2 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.202 |
| Average: |
38.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.202 |
| 10 |
33 |
|
[MG]E:1015 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
8 |
3 |
8205 |
36.1 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.130 |
| 11 |
34 |
|
E |
9 |
5 |
8205 |
f |
[MG]E:1015 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
35.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.149 |
| 12 |
35 |
|
[MG]C:1011 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
8290 |
32.8 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.037 |
| 13 |
36 |
|
[MG]A:1003 |
1 |
1 |
98 |
◊ |
A |
-y+1,x+1,z |
3_665 |
8 |
4 |
8283 |
32.6 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.119 |
| 14 |
37 |
|
[MG]E:1013 |
1 |
1 |
98 |
◊ |
E |
-y+1,x+1,z |
3_665 |
4 |
2 |
8205 |
30.6 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.132 |
38 |
|
[MG]B:1007 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
3 |
2 |
8176 |
30.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.132 |
39 |
|
D |
5 |
2 |
8253 |
◊ |
[MG]F:1016 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
30.0 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.132 |
40 |
|
[MG]C:1008 |
1 |
1 |
98 |
◊ |
B |
-y+1,x+1,z |
3_665 |
4 |
2 |
8259 |
29.8 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.132 |
41 |
|
[MG]D:1010 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
8290 |
29.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.132 |
42 |
|
A |
4 |
2 |
8283 |
◊ |
[MG]A:1001 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
29.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.132 |
| Average: |
29.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.132 |
| 15 |
43 |
|
[MG]F:1005 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
8259 |
29.2 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.127 |
44 |
|
[MG]F:1012 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
5 |
3 |
8176 |
28.9 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.127 |
45 |
|
C |
5 |
3 |
8290 |
◊ |
[MG]B:1004 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
28.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.127 |
46 |
|
[MG]C:1009 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
5 |
3 |
8253 |
28.7 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.127 |
47 |
|
E |
6 |
4 |
8205 |
◊ |
[MG]E:1014 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
28.2 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.127 |
48 |
|
[MG]A:1002 |
1 |
1 |
98 |
◊ |
A |
-y+1,x+1,z |
3_665 |
5 |
3 |
8283 |
25.2 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.127 |
| Average: |
28.2 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.127 |
| 16 |
49 |
|
[MG]A:1003 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
5 |
3 |
8283 |
27.0 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.091 |
| 17 |
50 |
|
[MG]A:1003 |
1 |
1 |
98 |
◊ |
[MG]A:1001 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
15.3 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.094 |
| 18 |
51 |
|
[MG]A:1003 |
1 |
1 |
98 |
f |
[MG]A:1002 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.1 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.069 |
| 19 |
52 |
|
[MG]A:1003 |
1 |
1 |
98 |
◊ |
B |
-y+1,x+1,z |
3_665 |
3 |
1 |
8259 |
8.8 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.011 |
| 20 |
53 |
|
D |
3 |
1 |
8253 |
◊ |
[MG]E:1015 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
7.1 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.003 |
| 21 |
54 |
|
[MG]F:1012 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
8205 |
6.6 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.024 |
55 |
|
[MG]F:1005 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
8290 |
6.3 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.024 |
56 |
|
A |
1 |
1 |
8283 |
◊ |
[MG]B:1004 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
6.0 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.024 |
57 |
|
D |
1 |
1 |
8253 |
◊ |
[MG]E:1014 |
-y+1,x+1,z |
3_665 |
1 |
1 |
98 |
5.9 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.024 |
58 |
|
[MG]C:1009 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
8176 |
5.5 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.024 |
59 |
|
[MG]A:1002 |
1 |
1 |
98 |
◊ |
B |
-y+1,x+1,z |
3_665 |
1 |
1 |
8259 |
4.6 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.024 |
| Average: |
5.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.024 |
|