| ## |
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 |
|
I |
73 |
21 |
7275 |
◊ |
F |
x,y,z |
1_555 |
71 |
21 |
7233 |
721.0 |
-9.1 |
0.136 |
8 |
0 |
0 |
1.000 |
2 |
|
G |
75 |
21 |
7398 |
◊ |
C |
x,y,z |
1_555 |
71 |
19 |
7386 |
719.6 |
-10.7 |
0.103 |
8 |
0 |
0 |
1.000 |
3 |
|
H |
69 |
21 |
7340 |
◊ |
E |
x,y,z |
1_555 |
68 |
19 |
7541 |
681.1 |
-10.1 |
0.111 |
8 |
0 |
0 |
1.000 |
4 |
|
D |
69 |
19 |
7328 |
◊ |
A |
x,y,z |
1_555 |
71 |
20 |
7292 |
661.7 |
-9.4 |
0.101 |
6 |
0 |
0 |
1.000 |
| Average: |
695.9 |
-9.8 |
0.113 |
8 |
0 |
0 |
1.000 |
| 2 |
5 |
|
J |
71 |
21 |
7456 |
◊ |
B |
x,y,z |
1_555 |
74 |
21 |
7365 |
677.9 |
-8.2 |
0.195 |
11 |
0 |
0 |
1.000 |
| 3 |
6 |
|
O |
40 |
11 |
1348 |
◊ |
E |
x,y,z |
1_555 |
56 |
17 |
7541 |
531.6 |
-8.4 |
0.276 |
3 |
3 |
0 |
0.469 |
7 |
|
Q |
43 |
11 |
1554 |
◊ |
G |
x,y,z |
1_555 |
55 |
15 |
7398 |
517.0 |
-7.7 |
0.337 |
3 |
1 |
0 |
0.469 |
8 |
|
N |
35 |
9 |
1329 |
◊ |
D |
x,y,z |
1_555 |
53 |
15 |
7328 |
476.6 |
-7.5 |
0.198 |
3 |
1 |
0 |
0.469 |
9 |
|
P |
35 |
8 |
1281 |
◊ |
F |
x,y,z |
1_555 |
57 |
15 |
7233 |
474.8 |
-9.6 |
0.105 |
3 |
2 |
0 |
0.469 |
| Average: |
500.0 |
-8.3 |
0.229 |
3 |
2 |
0 |
0.469 |
| 4 |
10 |
|
B |
48 |
12 |
7365 |
◊ |
A |
x,y,z |
1_555 |
64 |
16 |
7292 |
491.9 |
-2.8 |
0.402 |
3 |
1 |
0 |
0.000 |
| 5 |
11 |
|
K |
39 |
9 |
1327 |
◊ |
A |
x,y,z |
1_555 |
58 |
15 |
7292 |
482.8 |
-9.2 |
0.146 |
4 |
2 |
0 |
0.237 |
12 |
|
M |
41 |
8 |
1179 |
◊ |
C |
x,y,z |
1_555 |
58 |
16 |
7386 |
480.6 |
-9.2 |
0.188 |
2 |
1 |
0 |
0.237 |
| Average: |
481.7 |
-9.2 |
0.167 |
3 |
2 |
0 |
0.237 |
| 6 |
13 |
|
J |
49 |
13 |
7456 |
◊ |
C |
-x,y,-z-1 |
2_554 |
45 |
15 |
7386 |
460.0 |
-2.0 |
0.518 |
4 |
0 |
0 |
0.000 |
14 |
|
A |
47 |
15 |
7292 |
◊ |
B |
x,y-1,z |
1_545 |
47 |
13 |
7365 |
456.4 |
-3.0 |
0.434 |
2 |
0 |
0 |
0.000 |
15 |
|
F |
49 |
17 |
7233 |
◊ |
G |
-x+1/2,y-1/2,-z |
4_545 |
48 |
14 |
7398 |
455.2 |
-2.9 |
0.463 |
2 |
0 |
0 |
0.000 |
16 |
|
I |
47 |
16 |
7275 |
◊ |
E |
x,y,z |
1_555 |
49 |
14 |
7541 |
452.9 |
-3.6 |
0.396 |
2 |
0 |
0 |
0.000 |
17 |
|
H |
45 |
15 |
7340 |
◊ |
D |
x,y,z |
1_555 |
45 |
13 |
7328 |
434.1 |
-3.1 |
0.427 |
2 |
0 |
0 |
0.000 |
| Average: |
451.7 |
-2.9 |
0.447 |
2 |
0 |
0 |
0.000 |
| 7 |
18 |
|
L |
42 |
13 |
2305 |
◊ |
D |
x,y,z |
1_555 |
59 |
15 |
7328 |
433.6 |
-8.3 |
0.217 |
1 |
0 |
0 |
0.079 |
| 8 |
19 |
|
L |
42 |
10 |
2305 |
◊ |
A |
x,y,z |
1_555 |
57 |
12 |
7292 |
415.9 |
-7.5 |
0.300 |
1 |
1 |
0 |
0.073 |
| 9 |
20 |
|
L |
32 |
9 |
2305 |
◊ |
B |
x,y,z |
1_555 |
32 |
10 |
7365 |
320.3 |
-6.0 |
0.303 |
1 |
0 |
0 |
0.000 |
| 10 |
21 |
|
L |
26 |
8 |
2305 |
◊ |
C |
x,y,z |
1_555 |
34 |
10 |
7386 |
283.5 |
-2.3 |
0.602 |
3 |
0 |
0 |
0.000 |
| 11 |
22 |
|
E |
34 |
10 |
7541 |
x |
E |
-x+1/2,y-1/2,-z |
4_545 |
23 |
5 |
7541 |
253.5 |
-1.9 |
0.454 |
2 |
0 |
0 |
0.000 |
| 12 |
23 |
|
K |
25 |
6 |
1327 |
◊ |
K |
-x,y,-z-1 |
2_554 |
25 |
6 |
1327 |
194.1 |
-2.9 |
0.585 |
0 |
0 |
0 |
0.000 |
| 13 |
24 |
|
E |
19 |
5 |
7541 |
◊ |
F |
-x+1/2,y-1/2,-z |
4_545 |
21 |
6 |
7233 |
178.0 |
-0.1 |
0.600 |
1 |
2 |
0 |
0.000 |
| 14 |
25 |
|
G |
21 |
8 |
7398 |
◊ |
E |
x,y,z |
1_555 |
16 |
6 |
7541 |
163.7 |
3.2 |
0.913 |
1 |
0 |
0 |
0.000 |
| 15 |
26 |
|
H |
23 |
7 |
7340 |
◊ |
C |
x,y-1,z |
1_545 |
18 |
5 |
7386 |
157.7 |
1.2 |
0.777 |
0 |
1 |
0 |
0.000 |
| 16 |
27 |
|
N |
14 |
4 |
1329 |
◊ |
J |
-x,y,-z |
2_555 |
12 |
4 |
7456 |
128.9 |
-1.1 |
0.405 |
1 |
3 |
0 |
0.000 |
| 17 |
28 |
|
H |
18 |
7 |
7340 |
◊ |
J |
-x,y-1,-z |
2_545 |
18 |
5 |
7456 |
128.7 |
-0.8 |
0.515 |
0 |
0 |
0 |
0.000 |
| 18 |
29 |
|
H |
15 |
6 |
7340 |
◊ |
D |
x,y-1,z |
1_545 |
15 |
7 |
7328 |
120.2 |
1.2 |
0.775 |
0 |
0 |
0 |
0.000 |
| 19 |
30 |
|
Q |
10 |
3 |
1554 |
◊ |
F |
-x+1/2,y-1/2,-z |
4_545 |
14 |
4 |
7233 |
113.7 |
-1.1 |
0.510 |
1 |
1 |
0 |
0.000 |
| 20 |
31 |
|
A |
12 |
2 |
7292 |
◊ |
C |
-x,y-1,-z-1 |
2_544 |
13 |
2 |
7386 |
102.2 |
-0.3 |
0.589 |
0 |
0 |
0 |
0.003 |
| 21 |
32 |
|
H |
13 |
5 |
7340 |
◊ |
G |
x,y,z |
1_555 |
9 |
2 |
7398 |
95.7 |
0.5 |
0.719 |
1 |
0 |
0 |
0.000 |
| 22 |
33 |
|
[ACE]L:0 |
3 |
1 |
171 |
cf |
L |
x,y,z |
1_555 |
14 |
4 |
2305 |
76.9 |
-1.4 |
0.732 |
0 |
0 |
0 |
0.100 |
| 23 |
34 |
|
[SO4]C:401 |
4 |
1 |
186 |
f |
C |
x,y,z |
1_555 |
11 |
3 |
7386 |
73.1 |
-10.7 |
0.714 |
5 |
0 |
0 |
0.476 |
| 24 |
35 |
|
A |
8 |
3 |
7292 |
◊ |
[SO4]C:401 |
-x,y-1,-z-1 |
2_544 |
5 |
1 |
186 |
72.1 |
-10.5 |
0.801 |
2 |
0 |
0 |
0.125 |
| 25 |
36 |
|
E |
4 |
3 |
7541 |
◊ |
O |
-x+1/2,y-1/2,-z |
4_545 |
5 |
2 |
1348 |
62.8 |
-1.1 |
0.368 |
0 |
0 |
0 |
0.000 |
| 26 |
37 |
|
N |
7 |
2 |
1329 |
◊ |
B |
-x,y,-z |
2_555 |
8 |
3 |
7365 |
60.1 |
-0.9 |
0.445 |
0 |
0 |
0 |
0.000 |
| 27 |
38 |
|
K |
6 |
2 |
1327 |
◊ |
M |
-x,y-1,-z-1 |
2_544 |
7 |
2 |
1179 |
56.0 |
0.8 |
0.834 |
2 |
2 |
0 |
0.004 |
| 28 |
39 |
|
[ACE]L:0 |
3 |
1 |
171 |
◊ |
D |
x,y,z |
1_555 |
13 |
4 |
7328 |
49.1 |
-0.7 |
0.624 |
1 |
0 |
0 |
0.010 |
| 29 |
40 |
|
G |
6 |
2 |
7398 |
◊ |
F |
x,y,z-1 |
1_554 |
6 |
2 |
7233 |
47.9 |
0.7 |
0.768 |
1 |
1 |
0 |
0.000 |
| 30 |
41 |
|
C |
4 |
2 |
7386 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
7365 |
46.3 |
1.3 |
0.870 |
1 |
0 |
0 |
0.000 |
| 31 |
42 |
|
E |
5 |
3 |
7541 |
◊ |
I |
-x+1/2,y-1/2,-z |
4_545 |
4 |
2 |
7275 |
43.2 |
0.9 |
0.785 |
0 |
0 |
0 |
0.000 |
| 32 |
43 |
|
F |
3 |
1 |
7233 |
x |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
4 |
1 |
7233 |
38.7 |
0.6 |
0.800 |
1 |
1 |
0 |
0.000 |
| 33 |
44 |
|
P |
7 |
1 |
1281 |
◊ |
F |
-x+1/2,y-1/2,-z+1 |
4_546 |
7 |
3 |
7233 |
37.2 |
-0.6 |
0.514 |
0 |
0 |
0 |
0.000 |
| 34 |
45 |
|
O |
6 |
3 |
1348 |
◊ |
I |
-x+1/2,y-1/2,-z |
4_545 |
5 |
3 |
7275 |
34.1 |
-0.0 |
0.696 |
0 |
0 |
0 |
0.000 |
| 35 |
46 |
|
D |
3 |
1 |
7328 |
◊ |
B |
x,y,z |
1_555 |
2 |
1 |
7365 |
29.7 |
1.0 |
0.873 |
0 |
0 |
0 |
0.000 |
| 36 |
47 |
|
G |
3 |
2 |
7398 |
◊ |
F |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
7233 |
25.7 |
0.5 |
0.762 |
0 |
1 |
0 |
0.000 |
| 37 |
48 |
|
P |
3 |
2 |
1281 |
◊ |
I |
-x+1/2,y-1/2,-z+1 |
4_546 |
5 |
2 |
7275 |
21.6 |
-0.6 |
0.421 |
0 |
0 |
0 |
0.000 |
| 38 |
49 |
|
H |
2 |
1 |
7340 |
◊ |
B |
-x,y-1,-z |
2_545 |
3 |
1 |
7365 |
20.2 |
0.9 |
0.835 |
0 |
0 |
0 |
0.000 |
| 39 |
50 |
|
Q |
4 |
2 |
1554 |
◊ |
O |
x,y,z |
1_555 |
4 |
1 |
1348 |
16.1 |
0.2 |
0.732 |
0 |
0 |
0 |
0.000 |
| 40 |
51 |
|
H |
4 |
2 |
7340 |
◊ |
G |
x,y-1,z |
1_545 |
3 |
2 |
7398 |
14.4 |
-0.4 |
0.365 |
0 |
0 |
0 |
0.000 |
| 41 |
52 |
|
D |
3 |
1 |
7328 |
◊ |
B |
-x,y,-z |
2_555 |
1 |
1 |
7365 |
6.2 |
-0.1 |
0.643 |
0 |
0 |
0 |
0.000 |
| 42 |
53 |
|
[ACE]L:0 |
1 |
1 |
171 |
◊ |
A |
x,y,z |
1_555 |
3 |
2 |
7292 |
5.6 |
-0.2 |
0.588 |
0 |
0 |
0 |
0.002 |
| 43 |
54 |
|
Q |
2 |
2 |
1554 |
◊ |
E |
x,y,z |
1_555 |
2 |
2 |
7541 |
5.4 |
-0.0 |
0.654 |
0 |
0 |
0 |
0.000 |
| 44 |
55 |
|
A |
1 |
1 |
7292 |
◊ |
A |
-x,y,-z-1 |
2_554 |
1 |
1 |
7292 |
4.0 |
-0.1 |
0.396 |
0 |
0 |
0 |
0.000 |
| 45 |
56 |
|
Q |
1 |
1 |
1554 |
◊ |
I |
-x+1/2,y-1/2,-z |
4_545 |
3 |
1 |
7275 |
3.6 |
0.0 |
0.695 |
0 |
0 |
0 |
0.000 |
| 46 |
57 |
|
J |
1 |
1 |
7456 |
◊ |
D |
-x,y,-z |
2_555 |
1 |
1 |
7328 |
2.9 |
0.1 |
0.593 |
0 |
0 |
0 |
0.000 |
| 47 |
58 |
|
O |
1 |
1 |
1348 |
◊ |
F |
-x+1/2,y-1/2,-z |
4_545 |
1 |
1 |
7233 |
2.3 |
0.1 |
0.749 |
0 |
0 |
0 |
0.000 |
| 48 |
59 |
|
G |
1 |
1 |
7398 |
◊ |
J |
-x,y-1,-z-1 |
2_544 |
1 |
1 |
7456 |
1.7 |
0.0 |
0.633 |
0 |
0 |
0 |
0.000 |
|