## |
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 |
676 |
142 |
31261 |
◊ |
I |
x,y,z |
1_555 |
700 |
143 |
31760 |
6426.5 |
-53.0 |
0.994 |
366 |
0 |
0 |
1.000 |
2 |
2 |
|
B |
246 |
56 |
8238 |
◊ |
A |
x,y,z |
1_555 |
263 |
59 |
8650 |
2599.5 |
-42.4 |
0.060 |
23 |
3 |
0 |
1.000 |
3 |
|
F |
247 |
53 |
7480 |
◊ |
E |
x,y,z |
1_555 |
266 |
60 |
7709 |
2536.3 |
-40.5 |
0.060 |
23 |
3 |
0 |
1.000 |
Average: |
2567.9 |
-41.4 |
0.060 |
23 |
3 |
0 |
1.000 |
3 |
4 |
|
H |
250 |
59 |
7181 |
◊ |
G |
x,y,z |
1_555 |
230 |
57 |
8217 |
2437.5 |
-40.9 |
0.039 |
18 |
2 |
0 |
1.000 |
5 |
|
D |
232 |
59 |
6956 |
◊ |
C |
x,y,z |
1_555 |
230 |
56 |
8144 |
2350.6 |
-45.1 |
0.027 |
16 |
2 |
0 |
1.000 |
Average: |
2394.1 |
-43.0 |
0.033 |
17 |
2 |
0 |
1.000 |
4 |
6 |
|
K |
110 |
32 |
12847 |
◊ |
L |
x-y,x-1,z+1/6 |
6_545 |
119 |
38 |
12359 |
1115.5 |
-2.0 |
0.519 |
11 |
2 |
0 |
0.000 |
5 |
7 |
|
J |
91 |
18 |
31261 |
◊ |
A |
x,y,z |
1_555 |
79 |
23 |
8650 |
746.4 |
-10.4 |
0.636 |
13 |
0 |
0 |
1.000 |
6 |
8 |
|
L |
81 |
28 |
12359 |
◊ |
B |
x,y,z |
1_555 |
79 |
20 |
8238 |
745.1 |
0.3 |
0.625 |
6 |
5 |
0 |
0.000 |
9 |
|
K |
43 |
17 |
12847 |
◊ |
F |
x,y,z |
1_555 |
54 |
14 |
7480 |
427.2 |
1.1 |
0.699 |
4 |
4 |
0 |
0.000 |
Average: |
586.2 |
0.7 |
0.662 |
5 |
5 |
0 |
0.000 |
7 |
10 |
|
I |
76 |
13 |
31760 |
◊ |
A |
x,y,z |
1_555 |
76 |
22 |
8650 |
640.1 |
-9.6 |
0.618 |
17 |
0 |
0 |
1.000 |
8 |
11 |
|
C |
63 |
16 |
8144 |
◊ |
E |
x,y,z |
1_555 |
63 |
20 |
7709 |
620.3 |
-7.2 |
0.405 |
8 |
0 |
0 |
0.305 |
12 |
|
G |
60 |
17 |
8217 |
◊ |
A |
x,y,z |
1_555 |
55 |
19 |
8650 |
593.1 |
-7.5 |
0.345 |
7 |
0 |
0 |
0.305 |
Average: |
606.7 |
-7.3 |
0.375 |
8 |
0 |
0 |
0.305 |
9 |
13 |
|
E |
56 |
15 |
7709 |
◊ |
A |
x,y,z |
1_555 |
55 |
14 |
8650 |
564.6 |
-10.4 |
0.215 |
3 |
3 |
0 |
1.000 |
10 |
14 |
|
H |
49 |
12 |
7181 |
◊ |
F |
x,y,z |
1_555 |
57 |
11 |
7480 |
534.6 |
0.2 |
0.755 |
8 |
3 |
0 |
0.046 |
15 |
|
D |
50 |
11 |
6956 |
◊ |
B |
x,y,z |
1_555 |
45 |
10 |
8238 |
480.1 |
-2.6 |
0.583 |
4 |
4 |
0 |
0.046 |
Average: |
507.4 |
-1.2 |
0.669 |
6 |
4 |
0 |
0.046 |
11 |
16 |
|
I |
59 |
16 |
31760 |
◊ |
E |
x,y,z |
1_555 |
45 |
18 |
7709 |
471.7 |
-7.7 |
0.539 |
7 |
0 |
0 |
0.146 |
12 |
17 |
|
J |
61 |
14 |
31261 |
◊ |
E |
x,y,z |
1_555 |
51 |
18 |
7709 |
465.6 |
-5.2 |
0.672 |
10 |
0 |
0 |
0.253 |
13 |
18 |
|
K |
49 |
12 |
12847 |
◊ |
H |
x,y,z |
1_555 |
51 |
14 |
7181 |
447.8 |
0.4 |
0.699 |
2 |
3 |
0 |
0.000 |
19 |
|
L |
39 |
8 |
12359 |
◊ |
D |
x,y,z |
1_555 |
48 |
13 |
6956 |
418.5 |
0.7 |
0.756 |
3 |
3 |
0 |
0.000 |
Average: |
433.1 |
0.5 |
0.728 |
3 |
3 |
0 |
0.000 |
14 |
20 |
|
J |
52 |
9 |
31261 |
◊ |
C |
x,y,z |
1_555 |
47 |
13 |
8144 |
443.0 |
-3.9 |
0.623 |
10 |
0 |
0 |
0.119 |
15 |
21 |
|
G |
43 |
15 |
8217 |
◊ |
B |
x,y,z |
1_555 |
51 |
12 |
8238 |
411.6 |
-3.7 |
0.415 |
5 |
0 |
0 |
0.085 |
22 |
|
C |
44 |
14 |
8144 |
◊ |
F |
x,y,z |
1_555 |
42 |
12 |
7480 |
377.8 |
-5.3 |
0.306 |
5 |
0 |
0 |
0.085 |
Average: |
394.7 |
-4.5 |
0.361 |
5 |
0 |
0 |
0.085 |
16 |
23 |
|
I |
47 |
8 |
31760 |
◊ |
G |
x,y,z |
1_555 |
50 |
14 |
8217 |
408.3 |
-6.4 |
0.518 |
7 |
0 |
0 |
0.256 |
17 |
24 |
|
J |
44 |
9 |
31261 |
◊ |
B |
x,y,z |
1_555 |
40 |
16 |
8238 |
352.8 |
-6.0 |
0.512 |
7 |
0 |
0 |
0.029 |
18 |
25 |
|
I |
40 |
7 |
31760 |
◊ |
F |
x,y,z |
1_555 |
39 |
14 |
7480 |
346.7 |
-7.8 |
0.374 |
9 |
0 |
0 |
0.441 |
19 |
26 |
|
J |
45 |
11 |
31261 |
◊ |
F |
x,y,z |
1_555 |
35 |
11 |
7480 |
339.1 |
-4.4 |
0.567 |
3 |
0 |
0 |
0.012 |
20 |
27 |
|
I |
44 |
11 |
31760 |
◊ |
C |
x,y,z |
1_555 |
31 |
9 |
8144 |
302.7 |
0.4 |
0.831 |
0 |
0 |
0 |
0.000 |
21 |
28 |
|
I |
46 |
11 |
31760 |
◊ |
B |
x,y,z |
1_555 |
29 |
11 |
8238 |
286.8 |
-1.9 |
0.715 |
5 |
0 |
0 |
0.055 |
22 |
29 |
|
J |
40 |
9 |
31261 |
◊ |
G |
x,y,z |
1_555 |
30 |
9 |
8217 |
278.2 |
-1.6 |
0.685 |
5 |
0 |
0 |
0.055 |
23 |
30 |
|
I |
34 |
7 |
31760 |
◊ |
D |
x,y,z |
1_555 |
33 |
13 |
6956 |
265.8 |
-8.6 |
0.291 |
8 |
0 |
0 |
1.000 |
24 |
31 |
|
K |
32 |
13 |
12847 |
◊ |
E |
x,y,z |
1_555 |
26 |
6 |
7709 |
262.2 |
1.5 |
0.768 |
3 |
1 |
0 |
0.000 |
32 |
|
L |
37 |
13 |
12359 |
◊ |
A |
x,y,z |
1_555 |
25 |
6 |
8650 |
253.6 |
2.6 |
0.853 |
4 |
2 |
0 |
0.000 |
Average: |
257.9 |
2.1 |
0.811 |
4 |
2 |
0 |
0.000 |
25 |
33 |
|
J |
32 |
6 |
31261 |
◊ |
L |
x-1,y,z |
1_455 |
35 |
10 |
12359 |
259.5 |
-9.9 |
0.198 |
0 |
0 |
0 |
0.000 |
26 |
34 |
|
J |
28 |
7 |
31261 |
◊ |
H |
x,y,z |
1_555 |
27 |
12 |
7181 |
249.8 |
-7.3 |
0.329 |
5 |
0 |
0 |
0.021 |
27 |
35 |
|
K |
21 |
4 |
12847 |
◊ |
G |
x,y,z |
1_555 |
28 |
9 |
8217 |
214.0 |
3.0 |
0.876 |
4 |
8 |
0 |
0.000 |
28 |
36 |
|
I |
25 |
4 |
31760 |
◊ |
H |
x,y,z |
1_555 |
23 |
8 |
7181 |
210.7 |
-5.7 |
0.406 |
2 |
0 |
0 |
0.034 |
29 |
37 |
|
H |
22 |
7 |
7181 |
◊ |
B |
x,y,z |
1_555 |
23 |
6 |
8238 |
184.1 |
-1.8 |
0.517 |
2 |
0 |
0 |
0.104 |
38 |
|
D |
29 |
9 |
6956 |
◊ |
F |
x,y,z |
1_555 |
25 |
6 |
7480 |
181.0 |
-1.8 |
0.578 |
2 |
1 |
0 |
0.104 |
Average: |
182.5 |
-1.8 |
0.547 |
2 |
1 |
0 |
0.104 |
30 |
39 |
|
K |
19 |
6 |
12847 |
◊ |
J |
x-1,y,z |
1_455 |
21 |
5 |
31261 |
155.8 |
-6.4 |
0.161 |
1 |
0 |
0 |
0.000 |
31 |
40 |
|
L |
10 |
3 |
12359 |
◊ |
C |
x,y,z |
1_555 |
15 |
6 |
8144 |
114.5 |
1.9 |
0.842 |
3 |
4 |
0 |
0.000 |
32 |
41 |
|
G |
15 |
5 |
8217 |
◊ |
C |
x,y,z |
1_555 |
12 |
4 |
8144 |
105.4 |
0.5 |
0.735 |
0 |
0 |
0 |
0.000 |
33 |
42 |
|
[ACE]K:1 |
3 |
1 |
171 |
cf |
K |
x,y,z |
1_555 |
19 |
10 |
12847 |
94.2 |
-1.5 |
0.668 |
1 |
0 |
0 |
0.100 |
34 |
43 |
|
[ACE]L:1 |
3 |
1 |
170 |
cf |
L |
x,y,z |
1_555 |
15 |
8 |
12359 |
92.5 |
-1.6 |
0.613 |
1 |
0 |
0 |
0.100 |
35 |
44 |
|
J |
12 |
3 |
31261 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
6956 |
84.6 |
-2.8 |
0.333 |
0 |
0 |
0 |
0.011 |
36 |
45 |
|
K |
10 |
3 |
12847 |
◊ |
A |
x-1,y,z |
1_455 |
7 |
4 |
8650 |
67.4 |
-0.7 |
0.450 |
0 |
0 |
0 |
0.000 |
37 |
46 |
|
D |
4 |
2 |
6956 |
◊ |
G |
x,y,z |
1_555 |
7 |
3 |
8217 |
64.4 |
-0.4 |
0.560 |
0 |
0 |
0 |
0.009 |
47 |
|
H |
6 |
1 |
7181 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
8144 |
29.5 |
-0.5 |
0.525 |
0 |
0 |
0 |
0.009 |
Average: |
47.0 |
-0.5 |
0.542 |
0 |
0 |
0 |
0.009 |
38 |
48 |
|
I |
7 |
3 |
31760 |
x |
I |
x-y+1,x,z+1/6 |
6_655 |
9 |
2 |
31760 |
52.3 |
0.3 |
0.655 |
0 |
0 |
0 |
0.000 |
39 |
49 |
|
K |
4 |
2 |
12847 |
◊ |
D |
x-y,x-1,z+1/6 |
6_545 |
6 |
2 |
6956 |
43.7 |
-0.6 |
0.506 |
0 |
0 |
0 |
0.000 |
40 |
50 |
|
H |
7 |
3 |
7181 |
◊ |
L |
x-y,x-1,z+1/6 |
6_545 |
5 |
2 |
12359 |
42.5 |
-0.9 |
0.423 |
0 |
0 |
0 |
0.000 |
41 |
51 |
|
C |
3 |
1 |
8144 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
8650 |
33.0 |
0.3 |
0.737 |
0 |
0 |
0 |
0.000 |
52 |
|
G |
2 |
2 |
8217 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
7709 |
13.5 |
0.7 |
0.860 |
0 |
0 |
0 |
0.000 |
Average: |
23.2 |
0.5 |
0.799 |
0 |
0 |
0 |
0.000 |
42 |
53 |
|
J |
3 |
2 |
31261 |
◊ |
I |
x-y+1,x,z+1/6 |
6_655 |
4 |
2 |
31760 |
21.1 |
-0.4 |
0.506 |
0 |
0 |
0 |
0.000 |
43 |
54 |
|
D |
1 |
1 |
6956 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
7709 |
11.9 |
0.5 |
0.816 |
0 |
0 |
0 |
0.000 |
44 |
55 |
|
I |
3 |
1 |
31760 |
x |
I |
x-1,y,z |
1_455 |
1 |
1 |
31760 |
10.1 |
-1.0 |
0.260 |
0 |
0 |
0 |
0.000 |
45 |
56 |
|
K |
3 |
1 |
12847 |
◊ |
I |
x-1,y-1,z |
1_445 |
1 |
1 |
31760 |
10.1 |
-0.4 |
0.350 |
0 |
0 |
0 |
0.000 |
46 |
57 |
|
J |
1 |
1 |
31261 |
◊ |
I |
x-1,y-1,z |
1_445 |
4 |
2 |
31760 |
5.1 |
-0.4 |
0.298 |
0 |
0 |
0 |
0.000 |
47 |
58 |
|
I |
2 |
1 |
31760 |
◊ |
J |
x-y+1,x,z+1/6 |
6_655 |
2 |
2 |
31261 |
4.6 |
-0.1 |
0.418 |
0 |
0 |
0 |
0.000 |
48 |
59 |
|
H |
2 |
1 |
7181 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
6956 |
1.8 |
0.1 |
0.765 |
0 |
0 |
0 |
0.000 |
49 |
60 |
|
J |
1 |
1 |
31261 |
x |
J |
x,y-1,z |
1_545 |
1 |
1 |
31261 |
1.3 |
-0.1 |
0.284 |
0 |
0 |
0 |
0.000 |
50 |
61 |
|
I |
1 |
1 |
31760 |
◊ |
J |
x-1,y-1,z |
1_445 |
1 |
1 |
31261 |
1.0 |
-0.1 |
0.291 |
0 |
0 |
0 |
0.000 |
|