| ## |
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 |
113 |
34 |
13976 |
◊ |
A |
x,y,z |
1_555 |
104 |
31 |
14038 |
1019.9 |
-20.0 |
0.009 |
4 |
0 |
0 |
0.310 |
2 |
|
C |
111 |
33 |
13878 |
◊ |
B |
x-1,y,z |
1_455 |
108 |
30 |
13649 |
993.8 |
-20.9 |
0.005 |
4 |
1 |
0 |
0.310 |
| Average: |
1006.8 |
-20.4 |
0.007 |
4 |
1 |
0 |
0.310 |
| 2 |
3 |
|
C |
59 |
19 |
13878 |
◊ |
B |
x,y,z |
1_555 |
63 |
21 |
13649 |
565.5 |
-2.7 |
0.561 |
4 |
0 |
0 |
0.000 |
| 3 |
4 |
|
A |
57 |
15 |
14038 |
◊ |
B |
-x+1,y-1/2,-z+5/2 |
3_647 |
59 |
19 |
13649 |
526.5 |
-5.5 |
0.284 |
3 |
0 |
0 |
0.000 |
5 |
|
C |
54 |
14 |
13878 |
◊ |
D |
x-1/2,-y+1/2,-z+2 |
4_457 |
53 |
18 |
13976 |
492.5 |
-5.7 |
0.264 |
4 |
0 |
0 |
0.000 |
| Average: |
509.5 |
-5.6 |
0.274 |
4 |
0 |
0 |
0.000 |
| 4 |
6 |
|
C |
51 |
16 |
13878 |
◊ |
A |
x,y,z |
1_555 |
56 |
21 |
14038 |
509.7 |
2.1 |
0.867 |
8 |
0 |
0 |
0.000 |
| 5 |
7 |
|
B |
52 |
16 |
13649 |
◊ |
A |
x,y,z |
1_555 |
51 |
14 |
14038 |
480.5 |
-0.9 |
0.618 |
8 |
1 |
0 |
0.000 |
| 6 |
8 |
|
[AMP]B:401 |
23 |
1 |
472 |
f |
B |
x,y,z |
1_555 |
55 |
22 |
13649 |
352.8 |
-2.9 |
0.551 |
5 |
0 |
0 |
0.131 |
9 |
|
[AMP]A:401 |
23 |
1 |
467 |
f |
A |
x,y,z |
1_555 |
50 |
21 |
14038 |
344.6 |
-2.6 |
0.544 |
5 |
0 |
0 |
0.131 |
10 |
|
[AMP]C:401 |
22 |
1 |
466 |
f |
C |
x,y,z |
1_555 |
54 |
20 |
13878 |
339.1 |
-2.4 |
0.545 |
4 |
0 |
0 |
0.131 |
11 |
|
[AMP]D:401 |
23 |
1 |
473 |
f |
D |
x,y,z |
1_555 |
56 |
20 |
13976 |
338.9 |
-3.3 |
0.521 |
4 |
0 |
0 |
0.131 |
| Average: |
343.8 |
-2.8 |
0.540 |
5 |
0 |
0 |
0.131 |
| 7 |
12 |
|
D |
30 |
13 |
13976 |
◊ |
C |
x,y-1,z |
1_545 |
42 |
15 |
13878 |
304.3 |
1.6 |
0.824 |
5 |
3 |
0 |
0.000 |
| 8 |
13 |
|
[GOL]C:405 |
6 |
1 |
221 |
f |
C |
x,y,z |
1_555 |
27 |
12 |
13878 |
141.7 |
-0.3 |
0.607 |
7 |
0 |
0 |
0.047 |
| 9 |
14 |
|
[GOL]B:405 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
25 |
10 |
13649 |
136.1 |
-0.3 |
0.603 |
5 |
0 |
0 |
0.034 |
| 10 |
15 |
|
[GOL]C:404 |
6 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
21 |
10 |
13878 |
129.2 |
0.3 |
0.660 |
7 |
0 |
0 |
0.038 |
| 11 |
16 |
|
[ACT]A:403 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
24 |
10 |
14038 |
125.2 |
-0.8 |
0.618 |
1 |
0 |
0 |
0.016 |
| 12 |
17 |
|
[ACT]C:403 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
27 |
11 |
13878 |
124.9 |
-0.6 |
0.640 |
1 |
0 |
0 |
0.015 |
| 13 |
18 |
|
D |
14 |
6 |
13976 |
x |
D |
x-1/2,-y-1/2,-z+2 |
4_447 |
15 |
3 |
13976 |
123.5 |
-1.5 |
0.351 |
0 |
0 |
0 |
0.000 |
| 14 |
19 |
|
[GOL]D:404 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
18 |
9 |
13976 |
120.4 |
0.2 |
0.629 |
5 |
0 |
0 |
0.027 |
| 15 |
20 |
|
[GOL]A:404 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
23 |
6 |
14038 |
119.6 |
-0.3 |
0.594 |
3 |
0 |
0 |
0.021 |
| 16 |
21 |
|
[GOL]D:405 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
23 |
7 |
13976 |
117.6 |
-0.0 |
0.626 |
4 |
0 |
0 |
0.024 |
| 17 |
22 |
|
[ACT]D:403 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
21 |
10 |
13976 |
107.4 |
-0.6 |
0.599 |
3 |
0 |
0 |
0.026 |
| 18 |
23 |
|
[ACT]B:403 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
19 |
10 |
13649 |
106.9 |
-0.5 |
0.648 |
5 |
0 |
0 |
0.036 |
| 19 |
24 |
|
[ACT]D:406 |
4 |
1 |
184 |
f |
D |
x,y,z |
1_555 |
19 |
11 |
13976 |
106.6 |
-0.9 |
0.560 |
2 |
0 |
0 |
0.024 |
| 20 |
25 |
|
[GOL]A:405 |
5 |
1 |
222 |
◊ |
D |
x,y,z |
1_555 |
13 |
7 |
13976 |
104.1 |
-0.0 |
0.587 |
1 |
0 |
0 |
0.006 |
| 21 |
26 |
|
[ACT]B:404 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
23 |
9 |
13649 |
97.7 |
-0.4 |
0.629 |
4 |
0 |
0 |
0.029 |
| 22 |
27 |
|
[GOL]A:405 |
5 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
14038 |
73.1 |
-1.0 |
0.352 |
0 |
0 |
0 |
0.014 |
| 23 |
28 |
|
[NA]B:402 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
6 |
13649 |
64.7 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.339 |
29 |
|
[NA]C:402 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
6 |
13878 |
64.4 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.339 |
30 |
|
[NA]A:402 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
6 |
14038 |
64.0 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.339 |
31 |
|
[NA]D:402 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
8 |
6 |
13976 |
63.8 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.339 |
| Average: |
64.2 |
-12.5 |
0.000 |
0 |
0 |
0 |
0.339 |
| 24 |
32 |
|
[NA]A:406 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
13649 |
47.0 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.000 |
| 25 |
33 |
|
[NA]A:406 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
14038 |
45.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.078 |
| 26 |
34 |
|
[ACT]D:406 |
4 |
1 |
184 |
f |
[ACT]D:403 |
x,y,z |
1_555 |
4 |
1 |
184 |
37.2 |
-0.6 |
0.601 |
0 |
0 |
0 |
0.007 |
| 27 |
35 |
|
[GOL]D:405 |
3 |
1 |
220 |
f |
[GOL]D:404 |
x,y,z |
1_555 |
3 |
1 |
220 |
32.5 |
-0.6 |
0.458 |
0 |
0 |
0 |
0.008 |
| 28 |
36 |
|
[ACT]B:404 |
4 |
1 |
182 |
f |
[ACT]B:403 |
x,y,z |
1_555 |
4 |
1 |
182 |
32.3 |
-0.3 |
0.704 |
0 |
0 |
0 |
0.004 |
| 29 |
37 |
|
C |
2 |
1 |
13878 |
◊ |
[GOL]B:405 |
x-1,y,z |
1_455 |
2 |
1 |
220 |
30.6 |
-0.7 |
0.216 |
0 |
0 |
0 |
0.010 |
| 30 |
38 |
|
[GOL]C:405 |
2 |
1 |
221 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
13649 |
29.9 |
-0.7 |
0.273 |
0 |
0 |
0 |
0.010 |
| 31 |
39 |
|
A |
2 |
2 |
14038 |
◊ |
B |
x-1/2,-y+1/2,-z+2 |
4_457 |
1 |
1 |
13649 |
10.7 |
-0.0 |
0.532 |
0 |
0 |
0 |
0.000 |
| 32 |
40 |
|
C |
1 |
1 |
13878 |
◊ |
D |
x-1,y+1,z |
1_465 |
1 |
1 |
13976 |
7.5 |
0.4 |
0.867 |
0 |
0 |
0 |
0.000 |
| 33 |
41 |
|
[AMP]A:401 |
1 |
1 |
467 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
13878 |
3.4 |
-0.1 |
0.472 |
0 |
0 |
0 |
0.000 |
| 34 |
42 |
|
D |
2 |
2 |
13976 |
◊ |
C |
-x,y-1/2,-z+5/2 |
3_547 |
2 |
2 |
13878 |
3.2 |
-0.0 |
0.576 |
0 |
0 |
0 |
0.000 |
| 35 |
43 |
|
D |
1 |
1 |
13976 |
◊ |
B |
-x,y-1/2,-z+5/2 |
3_547 |
1 |
1 |
13649 |
0.9 |
0.0 |
0.700 |
0 |
0 |
0 |
0.000 |
|