| ## |
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 |
108 |
27 |
10362 |
◊ |
C |
x,y,z |
1_555 |
112 |
27 |
10535 |
1082.5 |
-19.1 |
0.017 |
10 |
1 |
0 |
1.000 |
2 |
|
B |
105 |
24 |
10401 |
◊ |
A |
x,y,z |
1_555 |
108 |
26 |
10462 |
1061.6 |
-21.2 |
0.008 |
8 |
0 |
0 |
1.000 |
| Average: |
1072.0 |
-20.2 |
0.012 |
9 |
1 |
0 |
1.000 |
| 2 |
3 |
|
B |
82 |
22 |
10401 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
81 |
21 |
10462 |
760.1 |
-0.2 |
0.722 |
7 |
13 |
0 |
0.000 |
| 3 |
4 |
|
C |
67 |
17 |
10535 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
59 |
13 |
10362 |
543.2 |
-1.3 |
0.627 |
8 |
12 |
0 |
0.000 |
| 4 |
5 |
|
D |
41 |
12 |
10362 |
◊ |
A |
x,y,z |
1_555 |
42 |
14 |
10462 |
371.2 |
-1.0 |
0.617 |
4 |
3 |
0 |
0.000 |
| 5 |
6 |
|
A |
43 |
13 |
10462 |
◊ |
D |
x-1,y,z-1 |
1_454 |
33 |
10 |
10362 |
323.3 |
-1.4 |
0.560 |
8 |
2 |
0 |
0.000 |
| 6 |
7 |
|
C |
36 |
11 |
10535 |
◊ |
B |
x,y,z |
1_555 |
24 |
5 |
10401 |
258.7 |
2.7 |
0.848 |
7 |
1 |
0 |
0.000 |
| 7 |
8 |
|
C |
27 |
8 |
10535 |
◊ |
B |
x-1,y,z |
1_455 |
26 |
7 |
10401 |
229.7 |
0.4 |
0.692 |
4 |
5 |
0 |
0.000 |
| 8 |
9 |
|
A |
18 |
4 |
10462 |
◊ |
D |
x,y,z-1 |
1_554 |
21 |
8 |
10362 |
177.3 |
-0.2 |
0.589 |
1 |
0 |
0 |
0.000 |
| 9 |
10 |
|
B |
15 |
7 |
10401 |
x |
B |
x-1,y,z |
1_455 |
25 |
6 |
10401 |
170.1 |
-1.2 |
0.488 |
0 |
0 |
0 |
0.000 |
11 |
|
C |
17 |
6 |
10535 |
x |
C |
x-1,y,z |
1_455 |
17 |
5 |
10535 |
141.6 |
-0.8 |
0.492 |
0 |
0 |
0 |
0.000 |
| Average: |
155.9 |
-1.0 |
0.490 |
0 |
0 |
0 |
0.000 |
| 10 |
12 |
|
B |
15 |
4 |
10401 |
◊ |
C |
x-1,y,z-1 |
1_454 |
17 |
6 |
10535 |
128.4 |
0.5 |
0.693 |
1 |
2 |
0 |
0.000 |
| 11 |
13 |
|
C |
7 |
3 |
10535 |
◊ |
A |
-x+2,y-1/2,-z+1 |
2_746 |
18 |
5 |
10462 |
126.9 |
-2.6 |
0.049 |
0 |
0 |
0 |
0.000 |
| 12 |
14 |
|
D |
16 |
4 |
10362 |
◊ |
A |
x-1,y,z |
1_455 |
14 |
4 |
10462 |
105.6 |
0.3 |
0.696 |
1 |
1 |
0 |
0.000 |
| 13 |
15 |
|
C |
11 |
3 |
10535 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
13 |
4 |
10462 |
103.7 |
1.5 |
0.828 |
2 |
4 |
0 |
0.000 |
| 14 |
16 |
|
[IMD]A:211 |
5 |
1 |
198 |
f |
A |
x,y,z |
1_555 |
16 |
6 |
10462 |
94.9 |
2.3 |
0.224 |
1 |
0 |
0 |
0.000 |
| 15 |
17 |
|
B |
7 |
3 |
10401 |
◊ |
D |
x-1,y,z-1 |
1_454 |
9 |
3 |
10362 |
91.1 |
2.7 |
0.944 |
1 |
0 |
0 |
0.000 |
| 16 |
18 |
|
[IMD]C:212 |
5 |
1 |
198 |
f |
C |
x,y,z |
1_555 |
19 |
7 |
10535 |
87.6 |
2.4 |
0.359 |
0 |
0 |
0 |
0.000 |
| 17 |
19 |
|
[IMD]D:213 |
5 |
1 |
198 |
f |
D |
x,y,z |
1_555 |
16 |
6 |
10362 |
84.8 |
1.1 |
0.141 |
0 |
0 |
0 |
0.000 |
| 18 |
20 |
|
B |
15 |
7 |
10401 |
◊ |
C |
x,y,z-1 |
1_554 |
7 |
1 |
10535 |
80.7 |
1.5 |
0.834 |
0 |
0 |
0 |
0.000 |
| 19 |
21 |
|
[IMD]B:211 |
5 |
1 |
198 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
10401 |
74.5 |
2.0 |
0.185 |
0 |
0 |
0 |
0.000 |
| 20 |
22 |
|
[IMD]B:212 |
5 |
1 |
198 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
10401 |
73.4 |
1.8 |
0.178 |
0 |
0 |
0 |
0.000 |
| 21 |
23 |
|
B |
7 |
3 |
10401 |
◊ |
D |
x,y,z-1 |
1_554 |
10 |
3 |
10362 |
71.2 |
0.2 |
0.388 |
0 |
0 |
0 |
0.000 |
| 22 |
24 |
|
[IMD]A:212 |
4 |
1 |
197 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
10462 |
69.4 |
1.5 |
0.213 |
0 |
0 |
0 |
0.000 |
| 23 |
25 |
|
[IMD]A:213 |
5 |
1 |
197 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
10462 |
68.7 |
1.4 |
0.160 |
0 |
0 |
0 |
0.000 |
| 24 |
26 |
|
[IMD]D:211 |
5 |
1 |
196 |
f |
D |
x,y,z |
1_555 |
11 |
4 |
10362 |
68.6 |
2.0 |
0.183 |
0 |
0 |
0 |
0.000 |
| 25 |
27 |
|
[IMD]B:213 |
5 |
1 |
196 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
10401 |
67.8 |
1.5 |
0.175 |
0 |
0 |
0 |
0.000 |
| 26 |
28 |
|
[IMD]D:212 |
5 |
1 |
197 |
f |
D |
x,y,z |
1_555 |
11 |
5 |
10362 |
67.6 |
0.6 |
0.071 |
0 |
0 |
0 |
0.000 |
| 27 |
29 |
|
[IMD]C:211 |
3 |
1 |
197 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
10535 |
66.6 |
2.1 |
0.460 |
0 |
0 |
0 |
0.000 |
| 28 |
30 |
|
[IMD]C:213 |
5 |
1 |
197 |
f |
C |
x,y,z |
1_555 |
10 |
5 |
10535 |
66.0 |
1.8 |
0.152 |
0 |
0 |
0 |
0.000 |
| 29 |
31 |
|
C |
7 |
3 |
10535 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
10462 |
58.1 |
0.1 |
0.628 |
1 |
1 |
0 |
0.000 |
| 30 |
32 |
|
[IMD]A:213 |
5 |
1 |
197 |
f |
[IMD]A:212 |
x,y,z |
1_555 |
5 |
1 |
197 |
50.3 |
2.7 |
0.012 |
0 |
0 |
0 |
0.000 |
| 31 |
33 |
|
[IMD]B:213 |
5 |
1 |
196 |
f |
[IMD]B:212 |
x,y,z |
1_555 |
5 |
1 |
198 |
48.5 |
2.6 |
0.011 |
0 |
0 |
0 |
0.000 |
| 32 |
34 |
|
[IMD]C:213 |
4 |
1 |
197 |
f |
[IMD]C:211 |
x,y,z |
1_555 |
5 |
1 |
197 |
44.5 |
2.3 |
0.016 |
0 |
0 |
0 |
0.000 |
| 33 |
35 |
|
C |
5 |
3 |
10535 |
◊ |
A |
-x+2,y-1/2,-z+2 |
2_747 |
3 |
3 |
10462 |
43.0 |
1.2 |
0.873 |
1 |
1 |
0 |
0.000 |
| 34 |
36 |
|
[IMD]B:212 |
5 |
1 |
198 |
f |
[IMD]B:211 |
x,y,z |
1_555 |
2 |
1 |
198 |
41.9 |
2.0 |
0.036 |
0 |
0 |
0 |
0.000 |
| 35 |
37 |
|
[IMD]C:213 |
4 |
1 |
197 |
f |
[IMD]C:212 |
x,y,z |
1_555 |
5 |
1 |
198 |
40.3 |
2.4 |
0.023 |
0 |
0 |
0 |
0.000 |
| 36 |
38 |
|
[IMD]B:213 |
3 |
1 |
196 |
f |
[IMD]B:211 |
x,y,z |
1_555 |
4 |
1 |
198 |
38.3 |
1.9 |
0.039 |
0 |
0 |
0 |
0.000 |
| 37 |
39 |
|
[IMD]D:212 |
2 |
1 |
197 |
f |
[IMD]D:211 |
x,y,z |
1_555 |
2 |
1 |
196 |
38.1 |
1.4 |
0.160 |
0 |
0 |
0 |
0.000 |
| 38 |
40 |
|
[IMD]A:213 |
3 |
1 |
197 |
f |
[IMD]A:211 |
x,y,z |
1_555 |
2 |
1 |
198 |
38.0 |
1.6 |
0.101 |
0 |
0 |
0 |
0.000 |
| 39 |
41 |
|
[IMD]D:213 |
2 |
1 |
198 |
f |
[IMD]D:211 |
x,y,z |
1_555 |
3 |
1 |
196 |
37.0 |
1.6 |
0.095 |
0 |
0 |
0 |
0.000 |
| 40 |
42 |
|
[NI]B:201 |
1 |
1 |
115 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
10401 |
36.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
1.000 |
43 |
|
[NI]D:201 |
1 |
1 |
115 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
10362 |
36.4 |
-6.1 |
0.000 |
0 |
0 |
0 |
1.000 |
44 |
|
[NI]A:201 |
1 |
1 |
115 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
10462 |
34.3 |
-5.3 |
0.000 |
0 |
0 |
0 |
1.000 |
45 |
|
[NI]C:201 |
1 |
1 |
115 |
f |
C |
x,y,z |
1_555 |
7 |
5 |
10535 |
33.8 |
-4.8 |
0.000 |
0 |
0 |
0 |
1.000 |
| Average: |
35.3 |
-5.5 |
0.000 |
0 |
0 |
0 |
1.000 |
| 41 |
46 |
|
[IMD]C:212 |
3 |
1 |
198 |
f |
[IMD]C:211 |
x,y,z |
1_555 |
4 |
1 |
197 |
36.3 |
1.9 |
0.040 |
0 |
0 |
0 |
0.000 |
| 42 |
47 |
|
A |
6 |
3 |
10462 |
◊ |
B |
x-1,y,z |
1_455 |
4 |
3 |
10401 |
35.1 |
-0.6 |
0.401 |
0 |
0 |
0 |
0.000 |
| 43 |
48 |
|
[IMD]D:213 |
4 |
1 |
198 |
f |
[IMD]D:212 |
x,y,z |
1_555 |
5 |
1 |
197 |
34.5 |
1.7 |
0.014 |
0 |
0 |
0 |
0.000 |
| 44 |
49 |
|
[IMD]D:212 |
3 |
1 |
197 |
f |
[NI]D:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
27.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
1.000 |
50 |
|
[IMD]A:212 |
3 |
1 |
197 |
f |
[NI]A:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
26.4 |
-1.9 |
0.000 |
0 |
0 |
0 |
1.000 |
| Average: |
27.2 |
-1.9 |
0.000 |
0 |
0 |
0 |
1.000 |
| 45 |
51 |
|
[IMD]C:211 |
5 |
1 |
197 |
f |
[NI]C:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
27.4 |
-1.7 |
0.000 |
0 |
0 |
0 |
1.000 |
52 |
|
[IMD]B:211 |
3 |
1 |
198 |
f |
[NI]B:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
26.5 |
-1.5 |
0.000 |
0 |
0 |
0 |
1.000 |
53 |
|
[IMD]C:213 |
3 |
1 |
197 |
f |
[NI]C:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
25.9 |
-1.7 |
0.000 |
0 |
0 |
0 |
1.000 |
54 |
|
[IMD]C:212 |
2 |
1 |
198 |
f |
[NI]C:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
23.3 |
-1.5 |
0.000 |
0 |
0 |
0 |
1.000 |
55 |
|
[IMD]A:211 |
4 |
1 |
198 |
f |
[NI]A:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
22.7 |
-1.4 |
0.000 |
0 |
0 |
0 |
1.000 |
| Average: |
25.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
1.000 |
| 46 |
56 |
|
[IMD]B:213 |
3 |
1 |
196 |
f |
[NI]B:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
25.9 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.134 |
57 |
|
[IMD]B:212 |
2 |
1 |
198 |
f |
[NI]B:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
25.5 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.134 |
58 |
|
[IMD]D:213 |
2 |
1 |
198 |
f |
[NI]D:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
23.0 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.134 |
| Average: |
24.8 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.134 |
| 47 |
59 |
|
[IMD]A:213 |
5 |
1 |
197 |
f |
[NI]A:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
25.7 |
-1.7 |
0.000 |
0 |
0 |
0 |
1.000 |
| 48 |
60 |
|
[IMD]D:211 |
4 |
1 |
196 |
f |
[NI]D:201 |
x,y,z |
1_555 |
1 |
1 |
115 |
25.4 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.063 |
| 49 |
61 |
|
[IMD]A:212 |
3 |
1 |
197 |
f |
[IMD]A:211 |
x,y,z |
1_555 |
2 |
1 |
198 |
23.3 |
1.2 |
0.095 |
0 |
0 |
0 |
0.000 |
| 50 |
62 |
|
D |
3 |
1 |
10362 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
2 |
10535 |
21.8 |
-0.7 |
0.224 |
0 |
0 |
0 |
0.000 |
| 51 |
63 |
|
C |
2 |
1 |
10535 |
◊ |
B |
-x+2,y-1/2,-z+1 |
2_746 |
3 |
2 |
10401 |
18.2 |
-0.0 |
0.550 |
0 |
0 |
0 |
0.000 |
| 52 |
64 |
|
B |
2 |
1 |
10401 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
3 |
2 |
10362 |
16.2 |
-0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
| 53 |
65 |
|
B |
1 |
1 |
10401 |
◊ |
[IMD]A:212 |
-x+2,y-1/2,-z+1 |
2_746 |
2 |
1 |
197 |
11.7 |
0.4 |
0.318 |
0 |
0 |
0 |
0.000 |
| 54 |
66 |
|
[IMD]C:213 |
1 |
1 |
197 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
2 |
1 |
10362 |
7.7 |
0.4 |
0.572 |
0 |
0 |
0 |
0.000 |
| 55 |
67 |
|
[IMD]C:211 |
2 |
1 |
197 |
◊ |
D |
-x+2,y-1/2,-z+2 |
2_747 |
2 |
1 |
10362 |
4.5 |
0.2 |
0.172 |
0 |
0 |
0 |
0.000 |
| 56 |
68 |
|
D |
1 |
1 |
10362 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
10401 |
0.4 |
0.0 |
0.711 |
0 |
0 |
0 |
0.000 |
| 57 |
69 |
|
C |
1 |
1 |
10535 |
◊ |
[IMD]A:213 |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
197 |
0.3 |
0.0 |
0.351 |
0 |
0 |
0 |
0.000 |
|