| ## |
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 |
106 |
17 |
7861 |
◊ |
B |
x,y,z |
1_555 |
105 |
16 |
7868 |
783.8 |
-9.8 |
0.984 |
6 |
0 |
0 |
0.059 |
| 2 |
2 |
|
D |
76 |
10 |
7861 |
◊ |
C |
x,y,z |
1_555 |
55 |
19 |
6580 |
638.6 |
-13.5 |
0.604 |
21 |
0 |
0 |
0.227 |
| 3 |
3 |
|
B |
71 |
9 |
7868 |
◊ |
A |
x,y,z |
1_555 |
59 |
19 |
6221 |
613.3 |
-13.3 |
0.586 |
19 |
0 |
0 |
0.174 |
| 4 |
4 |
|
B |
77 |
11 |
7868 |
◊ |
D |
x-1,y,z |
1_455 |
78 |
11 |
7861 |
603.6 |
-2.7 |
0.988 |
4 |
0 |
0 |
0.000 |
| 5 |
5 |
|
A |
59 |
15 |
6221 |
◊ |
C |
x,y-1,z |
1_545 |
50 |
15 |
6580 |
529.9 |
-4.6 |
0.297 |
5 |
1 |
0 |
0.059 |
| 6 |
6 |
|
A |
49 |
14 |
6221 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
39 |
10 |
6580 |
403.3 |
-2.4 |
0.426 |
1 |
2 |
0 |
0.000 |
| 7 |
7 |
|
A |
42 |
10 |
6221 |
◊ |
C |
-x+3,y-1/2,-z+1 |
2_846 |
38 |
12 |
6580 |
374.3 |
-3.8 |
0.278 |
2 |
2 |
0 |
0.000 |
| 8 |
8 |
|
[GTP]B:1 |
20 |
1 |
585 |
cf |
B |
x,y,z |
1_555 |
28 |
5 |
7868 |
202.5 |
0.1 |
0.861 |
3 |
0 |
0 |
0.010 |
| 9 |
9 |
|
D |
21 |
4 |
7861 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
6221 |
182.4 |
-0.1 |
0.768 |
4 |
0 |
0 |
0.008 |
| 10 |
10 |
|
[GTP]D:1 |
22 |
1 |
606 |
cf |
D |
x,y,z |
1_555 |
24 |
5 |
7861 |
170.3 |
-0.3 |
0.814 |
3 |
0 |
0 |
0.016 |
| 11 |
11 |
|
A |
17 |
7 |
6221 |
◊ |
D |
-x+3,y-1/2,-z+1 |
2_846 |
23 |
4 |
7861 |
168.1 |
-1.5 |
0.749 |
2 |
0 |
0 |
0.000 |
| 12 |
12 |
|
B |
19 |
2 |
7868 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
17 |
6 |
6580 |
148.4 |
0.1 |
0.458 |
0 |
0 |
0 |
0.000 |
| 13 |
13 |
|
B |
17 |
4 |
7868 |
◊ |
C |
x,y,z |
1_555 |
18 |
5 |
6580 |
119.4 |
-1.5 |
0.686 |
0 |
0 |
0 |
0.007 |
| 14 |
14 |
|
[GTP]D:1 |
17 |
1 |
606 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
16 |
2 |
7868 |
112.4 |
-0.3 |
0.731 |
1 |
0 |
0 |
0.003 |
| 15 |
15 |
|
D |
14 |
2 |
7861 |
◊ |
[GTP]B:1 |
-x+2,y-1/2,-z |
2_745 |
15 |
1 |
585 |
102.2 |
1.4 |
0.832 |
0 |
0 |
0 |
0.000 |
| 16 |
16 |
|
[GTP]D:1 |
14 |
1 |
606 |
◊ |
[GTP]B:1 |
-x+2,y-1/2,-z |
2_745 |
13 |
1 |
585 |
89.6 |
3.4 |
0.876 |
0 |
0 |
0 |
0.000 |
| 17 |
17 |
|
[MG]B:103 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
7868 |
61.5 |
-10.0 |
0.000 |
0 |
0 |
0 |
0.080 |
| 18 |
18 |
|
[MG]B:107 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
7868 |
58.7 |
-8.5 |
0.000 |
0 |
0 |
0 |
0.068 |
| 19 |
19 |
|
A |
8 |
3 |
6221 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
6 |
2 |
7868 |
55.1 |
1.3 |
0.807 |
0 |
0 |
0 |
0.000 |
| 20 |
20 |
|
[MG]D:103 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
7861 |
54.6 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.087 |
| 21 |
21 |
|
[MG]D:102 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
11 |
6 |
7861 |
53.8 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.089 |
| 22 |
22 |
|
[MG]B:105 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
4 |
7868 |
50.7 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.079 |
| 23 |
23 |
|
[MG]D:105 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
4 |
4 |
7861 |
49.6 |
-9.6 |
0.000 |
0 |
0 |
0 |
0.096 |
| 24 |
24 |
|
[MG]B:101 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
7868 |
48.6 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.061 |
| 25 |
25 |
|
[MG]D:101 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
7861 |
45.3 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.074 |
| 26 |
26 |
|
[MG]B:110 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
8 |
2 |
7868 |
44.9 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.050 |
| 27 |
27 |
|
[MG]D:108 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
6 |
7861 |
44.7 |
-6.8 |
0.000 |
0 |
0 |
0 |
0.068 |
| 28 |
28 |
|
[MG]D:106 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
7861 |
42.5 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.059 |
| 29 |
29 |
|
[GTP]D:1 |
7 |
1 |
606 |
f |
[MG]D:109 |
x,y,z |
1_555 |
1 |
1 |
98 |
41.3 |
-6.6 |
0.000 |
0 |
0 |
0 |
0.066 |
| 30 |
30 |
|
[GTP]D:1 |
8 |
1 |
606 |
f |
[MG]D:107 |
x,y,z |
1_555 |
1 |
1 |
98 |
39.2 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.055 |
| 31 |
31 |
|
[MG]C:202 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
6 |
3 |
6580 |
38.5 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
32 |
|
[MG]A:201 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
6 |
3 |
6221 |
36.3 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.100 |
| Average: |
37.4 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.100 |
| 32 |
33 |
|
[MG]B:102 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
6 |
1 |
7868 |
38.1 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.039 |
| 33 |
34 |
|
A |
6 |
4 |
6221 |
◊ |
[MG]C:202 |
-x+3,y-1/2,-z+1 |
2_846 |
1 |
1 |
98 |
37.7 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.000 |
35 |
|
[MG]A:201 |
1 |
1 |
98 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
4 |
2 |
6580 |
11.3 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
24.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 34 |
36 |
|
[MG]D:104 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
7 |
1 |
7861 |
37.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.045 |
| 35 |
37 |
|
[GTP]B:1 |
8 |
1 |
585 |
f |
[MG]B:109 |
x,y,z |
1_555 |
1 |
1 |
98 |
37.1 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.036 |
| 36 |
38 |
|
[MG]B:108 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
7868 |
36.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.047 |
| 37 |
39 |
|
[MG]B:108 |
1 |
1 |
98 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
11 |
4 |
6580 |
36.6 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.002 |
| 38 |
40 |
|
[MG]D:107 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
7 |
3 |
7861 |
35.7 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.050 |
| 39 |
41 |
|
[GTP]B:1 |
4 |
1 |
585 |
f |
[MG]B:112 |
x,y,z |
1_555 |
1 |
1 |
98 |
35.6 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.043 |
| 40 |
42 |
|
[MG]B:109 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
7868 |
35.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.038 |
| 41 |
43 |
|
[GTP]B:1 |
6 |
1 |
585 |
f |
[MG]B:111 |
x,y,z |
1_555 |
1 |
1 |
98 |
34.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.043 |
| 42 |
44 |
|
[MG]B:104 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
7868 |
33.6 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.032 |
| 43 |
45 |
|
A |
4 |
1 |
6221 |
f |
[MG]C:201 |
x,y-1,z |
1_545 |
1 |
1 |
98 |
33.0 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.051 |
| 44 |
46 |
|
[MG]B:106 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
4 |
2 |
7868 |
32.6 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.038 |
| 45 |
47 |
|
[MG]C:201 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
6 |
3 |
6580 |
32.6 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.028 |
| 46 |
48 |
|
[MG]B:106 |
1 |
1 |
98 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
7 |
3 |
6580 |
31.7 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.002 |
| 47 |
49 |
|
D |
7 |
3 |
7861 |
◊ |
C |
-x+3,y-1/2,-z+1 |
2_846 |
7 |
4 |
6580 |
28.6 |
0.0 |
0.661 |
0 |
0 |
0 |
0.000 |
| 48 |
50 |
|
[MG]D:104 |
1 |
1 |
98 |
◊ |
[GTP]B:1 |
-x+2,y-1/2,-z |
2_745 |
3 |
1 |
585 |
25.3 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.010 |
| 49 |
51 |
|
[MG]B:104 |
1 |
1 |
98 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
3 |
1 |
6580 |
24.1 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.001 |
| 50 |
52 |
|
[MG]B:112 |
1 |
1 |
98 |
f |
[MG]B:111 |
x,y,z |
1_555 |
1 |
1 |
98 |
24.0 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.039 |
| 51 |
53 |
|
[MG]D:101 |
1 |
1 |
98 |
◊ |
C |
-x+3,y-1/2,-z+1 |
2_846 |
5 |
2 |
6580 |
21.5 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 52 |
54 |
|
B |
2 |
1 |
7868 |
◊ |
[MG]C:201 |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
98 |
21.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 53 |
55 |
|
[GTP]D:1 |
3 |
1 |
606 |
◊ |
[MG]B:102 |
-x+2,y-1/2,-z |
2_745 |
1 |
1 |
98 |
19.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.007 |
| 54 |
56 |
|
[GTP]B:1 |
3 |
1 |
585 |
f |
[MG]B:110 |
x,y,z |
1_555 |
1 |
1 |
98 |
15.7 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.012 |
| 55 |
57 |
|
[MG]D:106 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
7868 |
13.8 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.009 |
| 56 |
58 |
|
[MG]B:110 |
1 |
1 |
98 |
f |
[MG]B:109 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.6 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.019 |
| 57 |
59 |
|
[MG]D:109 |
1 |
1 |
98 |
f |
[MG]D:107 |
x,y,z |
1_555 |
1 |
1 |
98 |
10.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.020 |
| 58 |
60 |
|
[MG]D:109 |
1 |
1 |
98 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
2 |
1 |
7868 |
9.9 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.004 |
| 59 |
61 |
|
A |
1 |
1 |
6221 |
◊ |
[MG]B:106 |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
98 |
7.4 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.000 |
| 60 |
62 |
|
[MG]B:112 |
1 |
1 |
98 |
f |
[MG]B:109 |
x,y,z |
1_555 |
1 |
1 |
98 |
6.9 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.011 |
| 61 |
63 |
|
[MG]B:112 |
1 |
1 |
98 |
f |
[MG]B:110 |
x,y,z |
1_555 |
1 |
1 |
98 |
5.8 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.009 |
| 62 |
64 |
|
[GTP]D:1 |
2 |
1 |
606 |
f |
[MG]D:105 |
x,y,z |
1_555 |
1 |
1 |
98 |
4.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.004 |
| 63 |
65 |
|
[MG]D:104 |
1 |
1 |
98 |
◊ |
B |
-x+2,y-1/2,-z |
2_745 |
1 |
1 |
7868 |
2.3 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
| 64 |
66 |
|
[MG]B:111 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
1 |
1 |
7868 |
2.3 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.003 |
| 65 |
67 |
|
D |
1 |
1 |
7861 |
◊ |
[MG]B:102 |
-x+2,y-1/2,-z |
2_745 |
1 |
1 |
98 |
1.7 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 66 |
68 |
|
[MG]D:106 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
6221 |
0.9 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 67 |
69 |
|
D |
1 |
1 |
7861 |
◊ |
[MG]C:201 |
-x+3,y-1/2,-z+1 |
2_846 |
1 |
1 |
98 |
0.6 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 68 |
70 |
|
[MG]B:107 |
1 |
1 |
98 |
f |
[MG]B:103 |
x,y,z |
1_555 |
1 |
1 |
98 |
0.5 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|