| ## |
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 |
707 |
145 |
32245 |
◊ |
I |
x,y,z |
1_555 |
675 |
145 |
33063 |
6540.7 |
-75.0 |
0.963 |
374 |
0 |
0 |
0.936 |
| 2 |
2 |
|
B |
247 |
55 |
7814 |
◊ |
A |
x,y,z |
1_555 |
279 |
62 |
8401 |
2623.4 |
-42.0 |
0.048 |
26 |
10 |
0 |
1.000 |
3 |
|
F |
227 |
49 |
6409 |
◊ |
E |
x,y,z |
1_555 |
254 |
57 |
8305 |
2465.9 |
-41.3 |
0.040 |
26 |
9 |
0 |
1.000 |
| Average: |
2544.6 |
-41.7 |
0.044 |
26 |
10 |
0 |
1.000 |
| 3 |
4 |
|
D |
256 |
61 |
8235 |
◊ |
C |
x,y,z |
1_555 |
249 |
60 |
8360 |
2562.4 |
-40.6 |
0.071 |
24 |
7 |
0 |
1.000 |
5 |
|
H |
246 |
59 |
7985 |
◊ |
G |
x,y,z |
1_555 |
240 |
61 |
8489 |
2439.4 |
-43.4 |
0.034 |
18 |
7 |
0 |
1.000 |
| Average: |
2500.9 |
-42.0 |
0.053 |
21 |
7 |
0 |
1.000 |
| 4 |
6 |
|
I |
92 |
17 |
33063 |
◊ |
A |
x,y,z |
1_555 |
72 |
19 |
8401 |
702.8 |
-13.4 |
0.624 |
10 |
0 |
0 |
0.535 |
| 5 |
7 |
|
G |
59 |
17 |
8489 |
◊ |
A |
x,y,z |
1_555 |
67 |
20 |
8401 |
692.1 |
-8.7 |
0.263 |
8 |
0 |
0 |
1.000 |
8 |
|
C |
59 |
17 |
8360 |
◊ |
E |
x,y,z |
1_555 |
62 |
21 |
8305 |
671.0 |
-9.9 |
0.178 |
5 |
0 |
0 |
1.000 |
| Average: |
681.5 |
-9.3 |
0.221 |
7 |
0 |
0 |
1.000 |
| 6 |
9 |
|
J |
83 |
16 |
32245 |
◊ |
E |
x,y,z |
1_555 |
69 |
21 |
8305 |
679.8 |
-10.3 |
0.539 |
12 |
0 |
0 |
1.000 |
| 7 |
10 |
|
I |
72 |
14 |
33063 |
◊ |
E |
x,y,z |
1_555 |
70 |
19 |
8305 |
638.7 |
-10.6 |
0.626 |
14 |
0 |
0 |
0.522 |
| 8 |
11 |
|
E |
60 |
15 |
8305 |
◊ |
A |
x,y,z |
1_555 |
63 |
15 |
8401 |
633.4 |
-8.9 |
0.264 |
0 |
2 |
0 |
0.235 |
| 9 |
12 |
|
J |
79 |
13 |
32245 |
◊ |
A |
x,y,z |
1_555 |
73 |
19 |
8401 |
633.2 |
-7.9 |
0.615 |
14 |
0 |
0 |
0.413 |
| 10 |
13 |
|
D |
51 |
12 |
8235 |
◊ |
B |
x,y,z |
1_555 |
59 |
11 |
7814 |
533.5 |
-1.9 |
0.645 |
6 |
4 |
0 |
0.193 |
14 |
|
H |
48 |
12 |
7985 |
◊ |
F |
x,y,z |
1_555 |
54 |
12 |
6409 |
481.8 |
-3.5 |
0.572 |
3 |
2 |
0 |
0.193 |
| Average: |
507.7 |
-2.7 |
0.609 |
5 |
3 |
0 |
0.193 |
| 11 |
15 |
|
I |
58 |
13 |
33063 |
◊ |
G |
x,y,z |
1_555 |
52 |
17 |
8489 |
489.7 |
-3.5 |
0.778 |
10 |
0 |
0 |
0.095 |
| 12 |
16 |
|
J |
60 |
13 |
32245 |
◊ |
C |
x,y,z |
1_555 |
50 |
17 |
8360 |
453.0 |
-4.0 |
0.635 |
9 |
0 |
0 |
0.113 |
| 13 |
17 |
|
I |
55 |
13 |
33063 |
◊ |
D |
x,y,z |
1_555 |
48 |
17 |
8235 |
445.9 |
-2.8 |
0.823 |
7 |
0 |
0 |
0.091 |
| 14 |
18 |
|
G |
44 |
15 |
8489 |
◊ |
B |
x,y,z |
1_555 |
53 |
13 |
7814 |
425.9 |
-3.2 |
0.455 |
5 |
0 |
0 |
0.075 |
19 |
|
C |
43 |
14 |
8360 |
◊ |
F |
x,y,z |
1_555 |
51 |
12 |
6409 |
420.3 |
-3.3 |
0.461 |
6 |
0 |
0 |
0.075 |
| Average: |
423.1 |
-3.2 |
0.458 |
6 |
0 |
0 |
0.075 |
| 15 |
20 |
|
J |
56 |
12 |
32245 |
◊ |
H |
x,y,z |
1_555 |
39 |
15 |
7985 |
417.2 |
-6.1 |
0.574 |
9 |
0 |
0 |
0.188 |
| 16 |
21 |
|
I |
57 |
13 |
33063 |
◊ |
C |
x,y,z |
1_555 |
45 |
12 |
8360 |
383.2 |
-3.9 |
0.771 |
5 |
0 |
0 |
0.045 |
| 17 |
22 |
|
J |
49 |
10 |
32245 |
◊ |
G |
x,y,z |
1_555 |
49 |
13 |
8489 |
378.8 |
-5.5 |
0.541 |
5 |
0 |
0 |
0.226 |
| 18 |
23 |
|
J |
44 |
8 |
32245 |
◊ |
D |
x,y,z |
1_555 |
38 |
12 |
8235 |
367.3 |
-7.8 |
0.409 |
7 |
0 |
0 |
0.205 |
| 19 |
24 |
|
I |
37 |
6 |
33063 |
◊ |
H |
x,y,z |
1_555 |
40 |
12 |
7985 |
359.5 |
-5.5 |
0.612 |
5 |
0 |
0 |
0.120 |
| 20 |
25 |
|
I |
44 |
8 |
33063 |
◊ |
F |
x,y,z |
1_555 |
42 |
16 |
6409 |
353.6 |
-6.8 |
0.570 |
8 |
0 |
0 |
0.160 |
| 21 |
26 |
|
J |
43 |
8 |
32245 |
◊ |
B |
x,y,z |
1_555 |
39 |
15 |
7814 |
347.5 |
-5.5 |
0.475 |
10 |
0 |
0 |
0.185 |
| 22 |
27 |
|
B |
34 |
9 |
7814 |
◊ |
H |
-x,y-1/2,-z-1/2 |
3_544 |
34 |
9 |
7985 |
302.2 |
-1.9 |
0.591 |
1 |
1 |
0 |
0.000 |
| 23 |
28 |
|
I |
38 |
12 |
33063 |
◊ |
B |
x,y,z |
1_555 |
31 |
12 |
7814 |
289.9 |
-4.9 |
0.589 |
4 |
0 |
0 |
0.104 |
| 24 |
29 |
|
B |
27 |
7 |
7814 |
◊ |
G |
-x,y-1/2,-z-1/2 |
3_544 |
35 |
10 |
8489 |
266.6 |
-0.0 |
0.684 |
1 |
2 |
0 |
0.000 |
| 25 |
30 |
|
H |
36 |
11 |
7985 |
◊ |
B |
x,y,z |
1_555 |
28 |
7 |
7814 |
261.4 |
-2.0 |
0.574 |
5 |
1 |
0 |
0.151 |
31 |
|
D |
31 |
10 |
8235 |
◊ |
F |
x,y,z |
1_555 |
27 |
7 |
6409 |
244.7 |
-1.3 |
0.606 |
5 |
1 |
0 |
0.151 |
| Average: |
253.1 |
-1.7 |
0.590 |
5 |
1 |
0 |
0.151 |
| 26 |
32 |
|
J |
32 |
8 |
32245 |
◊ |
F |
x,y,z |
1_555 |
25 |
9 |
6409 |
218.5 |
-2.9 |
0.581 |
3 |
0 |
0 |
0.078 |
| 27 |
33 |
|
G |
16 |
4 |
8489 |
◊ |
C |
x,y,z |
1_555 |
17 |
4 |
8360 |
116.4 |
0.2 |
0.705 |
2 |
0 |
0 |
0.009 |
| 28 |
34 |
|
I |
15 |
5 |
33063 |
◊ |
H |
-x,y-1/2,-z-1/2 |
3_544 |
19 |
6 |
7985 |
114.0 |
-3.6 |
0.473 |
0 |
0 |
0 |
0.000 |
| 29 |
35 |
|
I |
11 |
1 |
33063 |
◊ |
J |
x-1/2,-y+1/2,-z-1 |
4_454 |
13 |
2 |
32245 |
89.0 |
1.0 |
0.754 |
0 |
0 |
0 |
0.000 |
| 30 |
36 |
|
A |
10 |
4 |
8401 |
◊ |
G |
-x,y-1/2,-z-1/2 |
3_544 |
10 |
3 |
8489 |
81.1 |
0.7 |
0.732 |
0 |
0 |
0 |
0.000 |
| 31 |
37 |
|
A |
10 |
3 |
8401 |
◊ |
H |
-x,y-1/2,-z-1/2 |
3_544 |
10 |
4 |
7985 |
78.9 |
0.5 |
0.763 |
0 |
0 |
0 |
0.000 |
| 32 |
38 |
|
J |
11 |
3 |
32245 |
◊ |
E |
-x+1,y-1/2,-z-1/2 |
3_644 |
10 |
3 |
8305 |
77.4 |
-1.6 |
0.514 |
1 |
0 |
0 |
0.000 |
| 33 |
39 |
|
D |
8 |
2 |
8235 |
◊ |
G |
x,y,z |
1_555 |
6 |
3 |
8489 |
74.0 |
0.4 |
0.749 |
0 |
0 |
0 |
0.004 |
40 |
|
H |
6 |
2 |
7985 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
8360 |
70.6 |
-0.1 |
0.641 |
1 |
0 |
0 |
0.004 |
| Average: |
72.3 |
0.2 |
0.695 |
1 |
0 |
0 |
0.004 |
| 34 |
41 |
|
J |
12 |
3 |
32245 |
◊ |
I |
x-1/2,-y+1/2,-z-1 |
4_454 |
16 |
3 |
33063 |
67.7 |
1.2 |
0.744 |
0 |
0 |
0 |
0.000 |
| 35 |
42 |
|
J |
10 |
3 |
32245 |
◊ |
H |
-x,y-1/2,-z-1/2 |
3_544 |
7 |
3 |
7985 |
67.2 |
-1.4 |
0.417 |
0 |
0 |
0 |
0.000 |
| 36 |
43 |
|
[MN]I:104 |
1 |
1 |
123 |
f |
I |
x,y,z |
1_555 |
7 |
2 |
33063 |
57.1 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.147 |
| 37 |
44 |
|
[MN]I:103 |
1 |
1 |
123 |
f |
I |
x,y,z |
1_555 |
11 |
4 |
33063 |
57.0 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.128 |
| 38 |
45 |
|
J |
9 |
1 |
32245 |
x |
J |
x-1/2,-y+1/2,-z-1 |
4_454 |
7 |
1 |
32245 |
56.0 |
1.1 |
0.683 |
0 |
0 |
0 |
0.000 |
| 39 |
46 |
|
I |
6 |
1 |
33063 |
x |
I |
x-1/2,-y+1/2,-z-1 |
4_454 |
4 |
1 |
33063 |
50.9 |
0.3 |
0.664 |
2 |
0 |
0 |
0.000 |
| 40 |
47 |
|
[MN]I:101 |
1 |
1 |
123 |
f |
I |
x,y,z |
1_555 |
8 |
3 |
33063 |
49.4 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.108 |
| 41 |
48 |
|
[MN]I:102 |
1 |
1 |
123 |
f |
I |
x,y,z |
1_555 |
10 |
3 |
33063 |
48.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.095 |
| 42 |
49 |
|
D |
5 |
2 |
8235 |
◊ |
J |
-x,y-1/2,-z-1/2 |
3_544 |
4 |
2 |
32245 |
46.6 |
-1.5 |
0.381 |
1 |
0 |
0 |
0.000 |
| 43 |
50 |
|
D |
5 |
2 |
8235 |
◊ |
I |
-x,y-1/2,-z-1/2 |
3_544 |
7 |
2 |
33063 |
39.1 |
-0.2 |
0.633 |
0 |
0 |
0 |
0.000 |
| 44 |
51 |
|
J |
3 |
2 |
32245 |
◊ |
I |
-x+1,y-1/2,-z-1/2 |
3_644 |
4 |
2 |
33063 |
27.4 |
-0.7 |
0.458 |
0 |
0 |
0 |
0.000 |
| 45 |
52 |
|
C |
4 |
4 |
8360 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
8401 |
27.3 |
1.2 |
0.842 |
0 |
0 |
0 |
0.000 |
53 |
|
G |
4 |
4 |
8489 |
◊ |
E |
x,y,z |
1_555 |
6 |
4 |
8305 |
11.7 |
0.4 |
0.756 |
0 |
0 |
0 |
0.000 |
| Average: |
19.5 |
0.8 |
0.799 |
0 |
0 |
0 |
0.000 |
| 46 |
54 |
|
J |
3 |
2 |
32245 |
x |
J |
-x+1,y-1/2,-z-1/2 |
3_644 |
4 |
2 |
32245 |
26.2 |
-2.7 |
0.233 |
0 |
0 |
0 |
0.000 |
| 47 |
55 |
|
I |
3 |
1 |
33063 |
◊ |
J |
-x+1,y-1/2,-z-1/2 |
3_644 |
1 |
1 |
32245 |
20.5 |
-1.0 |
0.338 |
0 |
0 |
0 |
0.000 |
| 48 |
56 |
|
J |
1 |
1 |
32245 |
x |
J |
-x+1/2,-y+1,z-1/2 |
2_564 |
3 |
1 |
32245 |
18.4 |
0.0 |
0.570 |
0 |
0 |
0 |
0.000 |
| 49 |
57 |
|
[MN]I:102 |
1 |
1 |
123 |
◊ |
J |
x,y,z |
1_555 |
2 |
2 |
32245 |
15.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.002 |
| 50 |
58 |
|
[MN]I:101 |
1 |
1 |
123 |
◊ |
J |
x,y,z |
1_555 |
2 |
2 |
32245 |
13.9 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.002 |
| 51 |
59 |
|
I |
3 |
1 |
33063 |
◊ |
J |
x-1,y,z |
1_455 |
1 |
1 |
32245 |
7.8 |
-0.2 |
0.320 |
0 |
0 |
0 |
0.000 |
| 52 |
60 |
|
I |
2 |
2 |
33063 |
◊ |
G |
-x,y-1/2,-z-1/2 |
3_544 |
2 |
2 |
8489 |
7.7 |
-0.3 |
0.484 |
0 |
0 |
0 |
0.000 |
| 53 |
61 |
|
J |
1 |
1 |
32245 |
◊ |
I |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
33063 |
5.8 |
-0.6 |
0.177 |
0 |
0 |
0 |
0.000 |
| 54 |
62 |
|
[MN]I:103 |
1 |
1 |
123 |
◊ |
H |
x,y,z |
1_555 |
1 |
1 |
7985 |
3.0 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.003 |
| 55 |
63 |
|
[MN]I:103 |
1 |
1 |
123 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
32245 |
2.4 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 56 |
64 |
|
H |
1 |
1 |
7985 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
8235 |
2.1 |
0.1 |
0.649 |
0 |
0 |
0 |
0.000 |
| 57 |
65 |
|
I |
1 |
1 |
33063 |
x |
I |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
33063 |
1.4 |
-0.2 |
0.271 |
0 |
0 |
0 |
0.000 |
| 58 |
66 |
|
J |
1 |
1 |
32245 |
◊ |
I |
x-1,y,z |
1_455 |
1 |
1 |
33063 |
1.2 |
-0.1 |
0.280 |
0 |
0 |
0 |
0.000 |
| 59 |
67 |
|
I |
1 |
1 |
33063 |
◊ |
E |
-x+1,y-1/2,-z-1/2 |
3_644 |
2 |
1 |
8305 |
1.1 |
-0.1 |
0.436 |
0 |
0 |
0 |
0.000 |
| 60 |
68 |
|
I |
1 |
1 |
33063 |
◊ |
J |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
32245 |
0.6 |
-0.1 |
0.312 |
0 |
0 |
0 |
0.000 |
| 61 |
69 |
|
[MN]I:104 |
1 |
1 |
123 |
◊ |
J |
x,y,z |
1_555 |
1 |
1 |
32245 |
0.1 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|