## |
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 |
|
F |
208 |
58 |
12695 |
◊ |
E |
x,y,z |
1_555 |
216 |
59 |
11841 |
1942.3 |
-26.6 |
0.035 |
22 |
9 |
1 |
0.867 |
2 |
|
H |
199 |
58 |
12759 |
◊ |
G |
x,y,z |
1_555 |
220 |
60 |
11804 |
1927.3 |
-27.4 |
0.038 |
20 |
7 |
1 |
0.867 |
Average: |
1934.8 |
-27.0 |
0.037 |
21 |
8 |
1 |
0.867 |
2 |
3 |
|
D |
122 |
32 |
6426 |
◊ |
C |
x,y,z |
1_555 |
137 |
42 |
15269 |
1208.7 |
-8.5 |
0.316 |
14 |
4 |
0 |
0.930 |
4 |
|
B |
119 |
28 |
6503 |
◊ |
A |
x,y,z |
1_555 |
134 |
39 |
15035 |
1175.2 |
-9.2 |
0.248 |
11 |
4 |
0 |
0.930 |
Average: |
1192.0 |
-8.8 |
0.282 |
13 |
4 |
0 |
0.930 |
3 |
5 |
|
F |
93 |
28 |
12695 |
◊ |
A |
-x+1/2,y-1/2,-z+3 |
4_548 |
91 |
29 |
15035 |
763.4 |
-5.3 |
0.475 |
6 |
2 |
0 |
0.005 |
4 |
6 |
|
E |
66 |
16 |
11841 |
◊ |
C |
x,y,z |
1_555 |
69 |
18 |
15269 |
619.4 |
-3.2 |
0.536 |
6 |
2 |
0 |
0.007 |
7 |
|
G |
64 |
17 |
11804 |
◊ |
A |
x,y,z |
1_555 |
70 |
19 |
15035 |
610.6 |
-3.2 |
0.496 |
7 |
1 |
0 |
0.007 |
Average: |
615.0 |
-3.2 |
0.516 |
7 |
2 |
0 |
0.007 |
5 |
8 |
|
C |
63 |
15 |
15269 |
◊ |
A |
x,y,z |
1_555 |
56 |
14 |
15035 |
555.3 |
-3.0 |
0.314 |
6 |
3 |
0 |
0.000 |
6 |
9 |
|
C |
41 |
12 |
15269 |
◊ |
G |
x-1/2,y-1/2,z |
3_445 |
55 |
16 |
11804 |
457.2 |
-5.5 |
0.109 |
7 |
0 |
0 |
0.000 |
10 |
|
E |
61 |
18 |
11841 |
◊ |
A |
x,y-1,z |
1_545 |
41 |
13 |
15035 |
450.8 |
-6.0 |
0.127 |
7 |
0 |
0 |
0.000 |
Average: |
454.0 |
-5.8 |
0.118 |
7 |
0 |
0 |
0.000 |
7 |
11 |
|
F |
48 |
20 |
12695 |
◊ |
C |
x,y,z |
1_555 |
54 |
14 |
15269 |
449.5 |
-1.9 |
0.567 |
5 |
0 |
0 |
0.006 |
12 |
|
H |
54 |
19 |
12759 |
◊ |
A |
x,y,z |
1_555 |
52 |
14 |
15035 |
442.5 |
-2.3 |
0.536 |
7 |
0 |
0 |
0.006 |
Average: |
446.0 |
-2.1 |
0.551 |
6 |
0 |
0 |
0.006 |
8 |
13 |
|
A |
40 |
10 |
15035 |
◊ |
H |
-x+1/2,y-1/2,-z+2 |
4_547 |
37 |
13 |
12759 |
380.8 |
0.7 |
0.758 |
5 |
5 |
0 |
0.000 |
9 |
14 |
|
[2LJ]A:600 |
22 |
1 |
492 |
cf |
A |
x,y,z |
1_555 |
63 |
19 |
15035 |
343.0 |
4.0 |
0.581 |
8 |
0 |
0 |
0.002 |
15 |
|
[2LJ]C:301 |
22 |
1 |
494 |
cf |
C |
x,y,z |
1_555 |
59 |
18 |
15269 |
340.8 |
4.0 |
0.576 |
9 |
0 |
0 |
0.002 |
Average: |
341.9 |
4.0 |
0.579 |
9 |
0 |
0 |
0.002 |
10 |
16 |
|
B |
32 |
13 |
6503 |
◊ |
C |
x,y,z |
1_555 |
32 |
10 |
15269 |
273.0 |
-1.9 |
0.417 |
1 |
0 |
0 |
0.000 |
11 |
17 |
|
E |
28 |
9 |
11841 |
x |
E |
-x+1/2,y-1/2,-z+3 |
4_548 |
30 |
9 |
11841 |
258.5 |
1.7 |
0.831 |
4 |
0 |
0 |
0.000 |
12 |
18 |
|
F |
29 |
10 |
12695 |
◊ |
G |
-x+1/2,y-1/2,-z+3 |
4_548 |
25 |
9 |
11804 |
239.6 |
-1.9 |
0.437 |
2 |
0 |
0 |
0.002 |
13 |
19 |
|
E |
22 |
6 |
11841 |
◊ |
A |
-x+1/2,y-1/2,-z+3 |
4_548 |
16 |
7 |
15035 |
214.7 |
-1.3 |
0.446 |
1 |
2 |
0 |
0.001 |
14 |
20 |
|
H |
16 |
6 |
12759 |
◊ |
C |
-x,y,-z+2 |
2_557 |
23 |
6 |
15269 |
185.2 |
-2.4 |
0.310 |
1 |
0 |
0 |
0.000 |
15 |
21 |
|
H |
27 |
11 |
12759 |
◊ |
A |
-x+1/2,y-1/2,-z+2 |
4_547 |
22 |
9 |
15035 |
176.2 |
-1.7 |
0.475 |
0 |
0 |
0 |
0.000 |
16 |
22 |
|
E |
14 |
4 |
11841 |
◊ |
F |
-x+1/2,y-1/2,-z+3 |
4_548 |
13 |
3 |
12695 |
121.9 |
-0.7 |
0.523 |
0 |
1 |
0 |
0.000 |
17 |
23 |
|
[ACT]C:303 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
22 |
9 |
15269 |
112.9 |
-0.7 |
0.675 |
1 |
0 |
0 |
0.098 |
18 |
24 |
|
A |
11 |
6 |
15035 |
◊ |
G |
-x+1/2,y-1/2,-z+2 |
4_547 |
14 |
4 |
11804 |
107.5 |
0.0 |
0.655 |
1 |
1 |
0 |
0.000 |
19 |
25 |
|
[GOL]F:301 |
6 |
1 |
218 |
f |
F |
x,y,z |
1_555 |
19 |
10 |
12695 |
106.4 |
0.3 |
0.678 |
11 |
0 |
0 |
0.100 |
26 |
|
[GOL]H:301 |
6 |
1 |
219 |
f |
H |
x,y,z |
1_555 |
18 |
10 |
12759 |
99.8 |
0.3 |
0.664 |
10 |
0 |
0 |
0.100 |
Average: |
103.1 |
0.3 |
0.671 |
11 |
0 |
0 |
0.100 |
20 |
27 |
|
[GOL]C:302 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
14 |
6 |
6503 |
105.4 |
0.0 |
0.547 |
5 |
0 |
0 |
0.133 |
21 |
28 |
|
[GOL]G:301 |
5 |
1 |
218 |
f |
G |
x,y,z |
1_555 |
17 |
7 |
11804 |
103.2 |
-0.4 |
0.521 |
3 |
0 |
0 |
0.100 |
22 |
29 |
|
H |
12 |
2 |
12759 |
x |
H |
-x+1/2,y-1/2,-z+2 |
4_547 |
8 |
4 |
12759 |
82.3 |
0.2 |
0.564 |
0 |
0 |
0 |
0.000 |
23 |
30 |
|
[ACT]H:302 |
4 |
1 |
184 |
f |
H |
x,y,z |
1_555 |
13 |
5 |
12759 |
73.6 |
-0.3 |
0.681 |
2 |
0 |
0 |
0.023 |
24 |
31 |
|
E |
9 |
4 |
11841 |
◊ |
B |
x,y-1,z |
1_545 |
9 |
2 |
6503 |
69.7 |
0.5 |
0.710 |
1 |
0 |
0 |
0.000 |
25 |
32 |
|
[GOL]F:301 |
5 |
1 |
218 |
◊ |
E |
x,y,z |
1_555 |
10 |
4 |
11841 |
64.9 |
-1.8 |
0.214 |
0 |
0 |
0 |
0.038 |
33 |
|
[GOL]H:301 |
5 |
1 |
219 |
◊ |
G |
x,y,z |
1_555 |
9 |
4 |
11804 |
59.6 |
-1.5 |
0.210 |
0 |
0 |
0 |
0.038 |
Average: |
62.3 |
-1.7 |
0.212 |
0 |
0 |
0 |
0.038 |
26 |
34 |
|
[GOL]C:302 |
5 |
1 |
219 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
15269 |
61.6 |
-0.0 |
0.563 |
2 |
0 |
0 |
0.000 |
27 |
35 |
|
D |
8 |
3 |
6426 |
◊ |
G |
x-1/2,y-1/2,z |
3_445 |
7 |
3 |
11804 |
56.5 |
1.5 |
0.830 |
0 |
0 |
0 |
0.000 |
28 |
36 |
|
F |
6 |
3 |
12695 |
◊ |
C |
-x,y,-z+3 |
2_558 |
5 |
2 |
15269 |
48.5 |
-0.7 |
0.387 |
0 |
0 |
0 |
0.000 |
29 |
37 |
|
[2LJ]C:301 |
6 |
1 |
494 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
11841 |
37.2 |
-0.7 |
0.322 |
1 |
0 |
0 |
0.002 |
38 |
|
[2LJ]A:600 |
5 |
1 |
492 |
◊ |
G |
x,y,z |
1_555 |
4 |
1 |
11804 |
33.9 |
-0.9 |
0.298 |
1 |
0 |
0 |
0.002 |
Average: |
35.5 |
-0.8 |
0.310 |
1 |
0 |
0 |
0.002 |
30 |
39 |
|
[ACT]H:302 |
3 |
1 |
184 |
◊ |
G |
x,y,z |
1_555 |
8 |
5 |
11804 |
35.0 |
-0.7 |
0.568 |
0 |
0 |
0 |
0.013 |
31 |
40 |
|
[ACT]H:302 |
3 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
15035 |
31.3 |
-0.3 |
0.484 |
0 |
0 |
0 |
0.000 |
32 |
41 |
|
D |
2 |
1 |
6426 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
6503 |
29.0 |
0.6 |
0.378 |
0 |
0 |
0 |
0.000 |
33 |
42 |
|
H |
4 |
1 |
12759 |
◊ |
B |
-x+1/2,y-1/2,-z+2 |
4_547 |
1 |
1 |
6503 |
28.2 |
1.0 |
0.656 |
0 |
0 |
0 |
0.000 |
34 |
43 |
|
[ACT]H:302 |
2 |
1 |
184 |
f |
[GOL]H:301 |
x,y,z |
1_555 |
2 |
1 |
219 |
19.0 |
-0.1 |
0.612 |
0 |
0 |
0 |
0.002 |
35 |
44 |
|
G |
1 |
1 |
11804 |
◊ |
G |
-x+1,y,-z+2 |
2_657 |
1 |
1 |
11804 |
8.5 |
-0.3 |
0.260 |
0 |
0 |
0 |
0.000 |
36 |
45 |
|
E |
1 |
1 |
11841 |
◊ |
B |
-x+1/2,y-1/2,-z+3 |
4_548 |
3 |
3 |
6503 |
7.6 |
0.3 |
0.768 |
0 |
0 |
0 |
0.000 |
37 |
46 |
|
F |
1 |
1 |
12695 |
◊ |
B |
-x+1/2,y-1/2,-z+3 |
4_548 |
2 |
1 |
6503 |
6.9 |
0.3 |
0.799 |
0 |
0 |
0 |
0.000 |
38 |
47 |
|
[GOL]G:301 |
1 |
1 |
218 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15035 |
6.5 |
0.2 |
0.641 |
0 |
0 |
0 |
0.000 |
39 |
48 |
|
F |
2 |
2 |
12695 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
15035 |
4.8 |
-0.0 |
0.483 |
0 |
0 |
0 |
0.000 |
|