## |
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 |
|
B |
203 |
52 |
15190 |
◊ |
A |
x,y,z |
1_555 |
214 |
63 |
15110 |
2042.7 |
-20.1 |
0.190 |
35 |
10 |
0 |
0.702 |
2 |
|
C |
197 |
51 |
14999 |
◊ |
B |
x,y,z |
1_555 |
206 |
59 |
15190 |
2000.5 |
-18.4 |
0.255 |
39 |
14 |
0 |
0.702 |
3 |
|
C |
205 |
59 |
14999 |
◊ |
A |
x,y,z |
1_555 |
195 |
51 |
15110 |
1982.9 |
-19.8 |
0.158 |
35 |
13 |
0 |
0.702 |
Average: |
2008.7 |
-19.4 |
0.201 |
36 |
12 |
0 |
0.702 |
2 |
4 |
|
A |
97 |
39 |
15110 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
94 |
35 |
14999 |
857.4 |
-3.2 |
0.689 |
6 |
8 |
0 |
0.000 |
3 |
5 |
|
B |
46 |
16 |
15190 |
◊ |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
46 |
18 |
15110 |
404.8 |
-2.1 |
0.580 |
3 |
1 |
0 |
0.000 |
4 |
6 |
|
A |
26 |
9 |
15110 |
◊ |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
38 |
14 |
15190 |
281.6 |
-1.9 |
0.430 |
1 |
1 |
0 |
0.000 |
5 |
7 |
|
C |
21 |
8 |
14999 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
25 |
7 |
15190 |
233.5 |
-2.3 |
0.384 |
0 |
2 |
0 |
0.000 |
6 |
8 |
|
B |
25 |
9 |
15190 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
22 |
6 |
15190 |
212.8 |
-2.0 |
0.450 |
0 |
0 |
0 |
0.000 |
7 |
9 |
|
A |
22 |
8 |
15110 |
◊ |
C |
-x,y-1/2,-z+1/2 |
3_545 |
24 |
10 |
14999 |
157.0 |
-1.8 |
0.428 |
1 |
0 |
0 |
0.000 |
8 |
10 |
|
[ACT]C:2007 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
27 |
13 |
14999 |
131.8 |
-1.2 |
0.596 |
1 |
0 |
0 |
0.013 |
9 |
11 |
|
B |
14 |
4 |
15190 |
◊ |
A |
x-1,y,z |
1_455 |
11 |
3 |
15110 |
118.4 |
-0.1 |
0.618 |
0 |
0 |
0 |
0.000 |
10 |
12 |
|
B |
13 |
5 |
15190 |
x |
B |
x-1,y,z |
1_455 |
10 |
3 |
15190 |
117.9 |
-0.2 |
0.630 |
0 |
1 |
0 |
0.000 |
11 |
13 |
|
[ACT]C:2009 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
11 |
5 |
14999 |
100.9 |
-0.8 |
0.565 |
2 |
0 |
0 |
0.014 |
12 |
14 |
|
[ACT]B:2003 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
15190 |
97.7 |
-1.0 |
0.572 |
2 |
0 |
0 |
0.017 |
13 |
15 |
|
[ACT]B:2005 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
12 |
8 |
15190 |
92.0 |
-0.3 |
0.655 |
2 |
0 |
0 |
0.024 |
16 |
|
[ACT]C:2008 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
14 |
8 |
14999 |
91.8 |
-0.4 |
0.665 |
2 |
0 |
0 |
0.024 |
17 |
|
[ACT]A:2010 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
15110 |
79.1 |
-0.4 |
0.659 |
2 |
0 |
0 |
0.024 |
Average: |
87.6 |
-0.4 |
0.660 |
2 |
0 |
0 |
0.024 |
14 |
18 |
|
C |
11 |
3 |
14999 |
x |
C |
x-1,y,z |
1_455 |
12 |
4 |
14999 |
87.4 |
0.9 |
0.781 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[TRS]A:2001 |
4 |
1 |
241 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
15110 |
72.5 |
2.0 |
0.458 |
1 |
0 |
0 |
0.000 |
16 |
20 |
|
[TRS]A:2001 |
4 |
1 |
241 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
14999 |
71.6 |
1.9 |
0.455 |
1 |
0 |
0 |
0.000 |
17 |
21 |
|
[TRS]A:2001 |
5 |
1 |
241 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
15190 |
71.5 |
1.8 |
0.297 |
2 |
0 |
0 |
0.000 |
18 |
22 |
|
[ACT]B:2004 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
15190 |
69.1 |
0.2 |
0.696 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[NO3]C:503 |
4 |
1 |
169 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
14999 |
60.0 |
0.3 |
0.409 |
0 |
0 |
0 |
0.000 |
24 |
|
[NO3]A:503 |
4 |
1 |
168 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
15110 |
59.9 |
0.2 |
0.379 |
0 |
0 |
0 |
0.000 |
25 |
|
[NO3]B:503 |
4 |
1 |
168 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
15190 |
57.5 |
0.2 |
0.375 |
0 |
0 |
0 |
0.000 |
Average: |
59.1 |
0.2 |
0.387 |
0 |
0 |
0 |
0.000 |
20 |
26 |
|
[ACT]B:2004 |
3 |
1 |
184 |
f |
A |
x-1/2,-y+1/2,-z+1 |
4_456 |
11 |
4 |
15110 |
55.2 |
-0.8 |
0.586 |
0 |
0 |
0 |
0.008 |
21 |
27 |
|
[NO3]B:503 |
4 |
1 |
168 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
14999 |
54.9 |
0.2 |
0.347 |
1 |
0 |
0 |
0.004 |
28 |
|
[NO3]A:503 |
4 |
1 |
168 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
15190 |
54.3 |
0.2 |
0.357 |
1 |
0 |
0 |
0.004 |
29 |
|
[NO3]C:503 |
4 |
1 |
169 |
◊ |
A |
x,y,z |
1_555 |
9 |
5 |
15110 |
54.1 |
0.2 |
0.340 |
1 |
0 |
0 |
0.004 |
Average: |
54.4 |
0.2 |
0.348 |
1 |
0 |
0 |
0.004 |
22 |
30 |
|
[ACT]B:2005 |
3 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
14999 |
54.4 |
-0.3 |
0.684 |
0 |
0 |
0 |
0.005 |
31 |
|
[ACT]C:2008 |
3 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
15110 |
53.3 |
-0.2 |
0.697 |
0 |
0 |
0 |
0.005 |
32 |
|
[ACT]A:2010 |
3 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
15190 |
45.9 |
-0.2 |
0.682 |
0 |
0 |
0 |
0.005 |
Average: |
51.2 |
-0.3 |
0.688 |
0 |
0 |
0 |
0.005 |
23 |
33 |
|
[ACT]C:2006 |
3 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
15190 |
49.5 |
-1.2 |
0.468 |
0 |
0 |
0 |
0.010 |
24 |
34 |
|
A |
3 |
1 |
15110 |
◊ |
B |
-x+1/2,-y+1,z-1/2 |
2_564 |
7 |
2 |
15190 |
48.1 |
-0.9 |
0.218 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
A |
5 |
2 |
15110 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
7 |
3 |
15190 |
45.3 |
-0.0 |
0.643 |
0 |
0 |
0 |
0.000 |
26 |
36 |
|
[ACT]C:2006 |
3 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
14999 |
41.5 |
-1.0 |
0.456 |
0 |
0 |
0 |
0.006 |
27 |
37 |
|
[CU]C:502 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
15110 |
36.7 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.091 |
38 |
|
[CU]A:502 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
15190 |
36.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.091 |
39 |
|
[CU]B:502 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
14999 |
36.5 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.091 |
Average: |
36.6 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.091 |
28 |
40 |
|
B |
6 |
2 |
15190 |
◊ |
[ACT]A:2010 |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
182 |
35.9 |
-0.7 |
0.367 |
0 |
0 |
0 |
0.000 |
29 |
41 |
|
[ACT]C:2006 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
15110 |
35.7 |
-0.3 |
0.555 |
0 |
0 |
0 |
0.002 |
30 |
42 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
5 |
15110 |
35.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.099 |
43 |
|
[CU]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
5 |
15190 |
35.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.099 |
44 |
|
[CU]C:502 |
1 |
1 |
125 |
cf |
C |
x,y,z |
1_555 |
8 |
5 |
14999 |
35.4 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.099 |
Average: |
35.4 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.099 |
31 |
45 |
|
[NO3]B:503 |
3 |
1 |
168 |
f |
[CU]B:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
28.5 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.050 |
46 |
|
[NO3]C:503 |
3 |
1 |
169 |
f |
[CU]C:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
28.4 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.050 |
47 |
|
[NO3]A:503 |
3 |
1 |
168 |
f |
[CU]A:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
28.2 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.050 |
Average: |
28.4 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.050 |
32 |
48 |
|
A |
1 |
1 |
15110 |
x |
A |
x-1,y,z |
1_455 |
2 |
1 |
15110 |
7.4 |
-0.2 |
0.383 |
0 |
0 |
0 |
0.000 |
|