| ## |
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 |
|
C |
161 |
43 |
19741 |
◊ |
C |
-x+1,-y,z |
4_655 |
161 |
43 |
19741 |
1360.1 |
-1.5 |
0.650 |
20 |
2 |
0 |
0.000 |
2 |
|
B |
153 |
45 |
19945 |
◊ |
A |
x,y,z |
1_555 |
156 |
45 |
20716 |
1291.2 |
-4.6 |
0.470 |
13 |
0 |
0 |
0.000 |
| Average: |
1325.7 |
-3.0 |
0.560 |
17 |
1 |
0 |
0.000 |
| 2 |
3 |
|
A |
106 |
24 |
20716 |
◊ |
A |
-x,-y,z |
4_555 |
106 |
25 |
20716 |
986.3 |
-1.9 |
0.551 |
6 |
0 |
0 |
0.000 |
| 3 |
4 |
|
C |
72 |
22 |
19741 |
◊ |
B |
x,y,z |
1_555 |
74 |
23 |
19945 |
665.2 |
-2.5 |
0.467 |
10 |
0 |
0 |
0.000 |
| 4 |
5 |
|
A |
45 |
17 |
20716 |
◊ |
B |
-y,x-y,z-1/3 |
2_554 |
44 |
14 |
19945 |
455.0 |
1.6 |
0.763 |
8 |
2 |
0 |
0.000 |
| 5 |
6 |
|
B |
38 |
14 |
19945 |
◊ |
A |
x-y,x,z+1/3 |
6_555 |
37 |
14 |
20716 |
346.5 |
-0.8 |
0.403 |
3 |
0 |
0 |
0.000 |
| 6 |
7 |
|
A |
46 |
14 |
20716 |
x |
A |
x-y,x,z+1/3 |
6_555 |
28 |
13 |
20716 |
307.7 |
-2.8 |
0.288 |
0 |
0 |
0 |
0.000 |
| 7 |
8 |
|
B |
31 |
10 |
19945 |
◊ |
A |
-x,-y,z |
4_555 |
25 |
7 |
20716 |
245.3 |
1.7 |
0.783 |
2 |
1 |
0 |
0.000 |
| 8 |
9 |
|
B |
28 |
10 |
19945 |
◊ |
C |
x-y,x,z+1/3 |
6_555 |
23 |
8 |
19741 |
215.3 |
-1.3 |
0.410 |
0 |
0 |
0 |
0.000 |
| 9 |
10 |
|
[GOL]B:610 |
6 |
1 |
220 |
f |
B |
x,y,z |
1_555 |
30 |
12 |
19945 |
153.4 |
-0.5 |
0.530 |
3 |
0 |
0 |
0.004 |
| 10 |
11 |
|
[GOL]A:611 |
6 |
1 |
222 |
f |
A |
x,y,z |
1_555 |
21 |
8 |
20716 |
135.8 |
-0.9 |
0.428 |
0 |
0 |
0 |
0.012 |
| 11 |
12 |
|
A |
20 |
8 |
20716 |
◊ |
C |
-y,x-y,z-1/3 |
2_554 |
18 |
7 |
19741 |
134.1 |
0.2 |
0.626 |
1 |
0 |
0 |
0.000 |
| 12 |
13 |
|
[ACT]C:606 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
23 |
9 |
19741 |
125.0 |
-0.3 |
0.682 |
3 |
0 |
0 |
0.022 |
| 13 |
14 |
|
[ACT]C:604 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
20 |
9 |
19741 |
123.9 |
-0.7 |
0.602 |
2 |
0 |
0 |
0.020 |
| 14 |
15 |
|
[ACT]A:604 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
20 |
9 |
20716 |
123.5 |
0.5 |
0.754 |
2 |
0 |
0 |
0.005 |
| 15 |
16 |
|
[SO4]B:613 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
19945 |
121.4 |
-20.3 |
0.488 |
5 |
0 |
0 |
0.049 |
| 16 |
17 |
|
[ACT]A:605 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
25 |
11 |
20716 |
117.1 |
-0.8 |
0.589 |
3 |
0 |
0 |
0.029 |
| 17 |
18 |
|
C |
13 |
5 |
19741 |
◊ |
A |
x-y+1,x,z+1/3 |
6_655 |
9 |
3 |
20716 |
106.1 |
-0.6 |
0.344 |
0 |
0 |
0 |
0.000 |
| 18 |
19 |
|
[GOL]A:613 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
20716 |
105.1 |
0.2 |
0.638 |
4 |
0 |
0 |
0.021 |
| 19 |
20 |
|
[GOL]B:612 |
6 |
1 |
219 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
19945 |
92.5 |
-0.1 |
0.542 |
3 |
0 |
0 |
0.003 |
| 20 |
21 |
|
[ACT]A:608 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
20716 |
89.8 |
-0.9 |
0.531 |
0 |
0 |
0 |
0.012 |
| 21 |
22 |
|
[GOL]B:612 |
5 |
1 |
219 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
20716 |
86.9 |
-0.9 |
0.355 |
0 |
0 |
0 |
0.000 |
| 22 |
23 |
|
[GOL]C:607 |
6 |
1 |
220 |
f |
C |
x,y,z |
1_555 |
14 |
5 |
19741 |
86.3 |
-0.1 |
0.548 |
2 |
0 |
0 |
0.013 |
| 23 |
24 |
|
[GOL]A:612 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
20716 |
85.2 |
-0.5 |
0.540 |
2 |
0 |
0 |
0.019 |
| 24 |
25 |
|
[ACT]A:607 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
20716 |
82.2 |
-0.5 |
0.608 |
1 |
0 |
0 |
0.013 |
| 25 |
26 |
|
[ACT]B:609 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
14 |
5 |
19945 |
81.6 |
-0.3 |
0.643 |
0 |
0 |
0 |
0.000 |
| 26 |
27 |
|
[ACT]A:610 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
13 |
5 |
20716 |
80.2 |
-0.3 |
0.647 |
1 |
0 |
0 |
0.011 |
| 27 |
28 |
|
[CL]B:604 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
19945 |
79.7 |
-12.3 |
0.000 |
0 |
0 |
0 |
0.027 |
| 28 |
29 |
|
[ACT]B:606 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
14 |
4 |
19945 |
74.4 |
-0.1 |
0.589 |
1 |
0 |
0 |
0.001 |
| 29 |
30 |
|
[ACT]B:608 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
19945 |
73.0 |
0.6 |
0.812 |
2 |
0 |
0 |
0.000 |
| 30 |
31 |
|
B |
8 |
4 |
19945 |
x |
B |
x-y,x,z+1/3 |
6_555 |
6 |
3 |
19945 |
69.3 |
0.5 |
0.541 |
0 |
2 |
0 |
0.000 |
| 31 |
32 |
|
[ACT]C:605 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
13 |
5 |
19741 |
68.6 |
0.1 |
0.705 |
3 |
0 |
0 |
0.016 |
| 32 |
33 |
|
[ACT]B:607 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
13 |
5 |
19945 |
68.0 |
-0.6 |
0.573 |
2 |
0 |
0 |
0.003 |
| 33 |
34 |
|
[GOL]C:608 |
4 |
1 |
221 |
f |
C |
x,y,z |
1_555 |
13 |
4 |
19741 |
66.8 |
-0.6 |
0.431 |
1 |
0 |
0 |
0.014 |
| 34 |
35 |
|
A |
10 |
5 |
20716 |
◊ |
C |
x-y,x,z-2/3 |
6_554 |
5 |
3 |
19741 |
65.7 |
1.8 |
0.867 |
0 |
0 |
0 |
0.000 |
| 35 |
36 |
|
[GOL]C:608 |
4 |
1 |
221 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
19945 |
62.9 |
0.2 |
0.585 |
0 |
0 |
0 |
0.000 |
| 36 |
37 |
|
[GOL]B:611 |
4 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
10 |
5 |
19945 |
62.6 |
0.9 |
0.733 |
3 |
0 |
0 |
0.000 |
| 37 |
38 |
|
[ACT]A:606 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
20716 |
61.6 |
0.5 |
0.792 |
0 |
0 |
0 |
0.000 |
| 38 |
39 |
|
A |
9 |
3 |
20716 |
◊ |
[ACT]C:605 |
-y,x-y,z-1/3 |
2_554 |
3 |
1 |
183 |
54.3 |
0.1 |
0.749 |
1 |
0 |
0 |
0.000 |
| 39 |
40 |
|
[ACT]B:614 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
6 |
3 |
19945 |
54.0 |
0.5 |
0.811 |
0 |
0 |
0 |
0.000 |
| 40 |
41 |
|
[GOL]A:613 |
4 |
1 |
217 |
◊ |
A |
-x,-y,z |
4_555 |
8 |
3 |
20716 |
52.9 |
-0.5 |
0.494 |
1 |
0 |
0 |
0.000 |
| 41 |
42 |
|
[ACT]B:605 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
5 |
3 |
19945 |
51.1 |
-0.5 |
0.392 |
1 |
0 |
0 |
0.002 |
| 42 |
43 |
|
[ACT]A:609 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
20716 |
43.7 |
1.6 |
0.882 |
1 |
0 |
0 |
0.000 |
| 43 |
44 |
|
[ACT]B:614 |
3 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
3 |
2 |
19741 |
43.3 |
-1.1 |
0.205 |
0 |
0 |
0 |
0.014 |
| 44 |
45 |
|
[SO4]C:609 |
4 |
1 |
186 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
19741 |
42.4 |
-3.4 |
0.975 |
1 |
0 |
0 |
0.000 |
| 45 |
46 |
|
B |
7 |
3 |
19945 |
◊ |
[ACT]A:607 |
x-y,x,z+1/3 |
6_555 |
2 |
1 |
183 |
40.6 |
-0.3 |
0.561 |
0 |
0 |
0 |
0.000 |
| 46 |
47 |
|
[SO4]C:609 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
3 |
1 |
19945 |
38.3 |
-3.8 |
0.938 |
1 |
0 |
0 |
0.009 |
| 47 |
48 |
|
[GOL]A:613 |
4 |
1 |
217 |
◊ |
B |
-x,-y,z |
4_555 |
3 |
1 |
19945 |
36.6 |
0.2 |
0.654 |
0 |
0 |
0 |
0.000 |
| 48 |
49 |
|
B |
1 |
1 |
19945 |
◊ |
[ACT]B:609 |
x-y,x,z+1/3 |
6_555 |
1 |
1 |
183 |
4.5 |
-0.1 |
0.391 |
0 |
0 |
0 |
0.000 |
| 49 |
50 |
|
C |
1 |
1 |
19741 |
◊ |
[ACT]A:610 |
x-y+1,x,z+1/3 |
6_655 |
1 |
1 |
182 |
3.4 |
-0.1 |
0.417 |
0 |
0 |
0 |
0.000 |
|