## |
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 |
202 |
52 |
15202 |
◊ |
A |
x,y,z |
1_555 |
213 |
62 |
15115 |
2044.3 |
-20.0 |
0.190 |
39 |
10 |
0 |
0.676 |
2 |
|
C |
199 |
51 |
15006 |
◊ |
B |
x,y,z |
1_555 |
206 |
60 |
15202 |
2006.3 |
-19.1 |
0.236 |
36 |
12 |
0 |
0.676 |
3 |
|
C |
206 |
59 |
15006 |
◊ |
A |
x,y,z |
1_555 |
192 |
51 |
15115 |
1976.1 |
-18.7 |
0.194 |
35 |
13 |
0 |
0.676 |
Average: |
2008.9 |
-19.3 |
0.206 |
37 |
12 |
0 |
0.676 |
2 |
4 |
|
A |
100 |
41 |
15115 |
◊ |
C |
-x+1,y-1/2,-z-1/2 |
3_644 |
102 |
36 |
15006 |
880.8 |
-3.6 |
0.682 |
7 |
8 |
0 |
0.000 |
3 |
5 |
|
B |
47 |
15 |
15202 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
43 |
16 |
15115 |
398.3 |
-1.7 |
0.616 |
2 |
1 |
0 |
0.000 |
4 |
6 |
|
A |
25 |
9 |
15115 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
39 |
14 |
15202 |
283.2 |
-1.7 |
0.433 |
2 |
1 |
0 |
0.000 |
5 |
7 |
|
C |
19 |
8 |
15006 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
25 |
7 |
15202 |
232.9 |
-2.2 |
0.373 |
0 |
2 |
0 |
0.000 |
6 |
8 |
|
B |
26 |
10 |
15202 |
x |
B |
x-1/2,-y-1/2,-z |
4_445 |
22 |
7 |
15202 |
191.7 |
-1.8 |
0.483 |
0 |
0 |
0 |
0.000 |
7 |
9 |
|
A |
23 |
8 |
15115 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
27 |
10 |
15006 |
187.9 |
-2.1 |
0.395 |
0 |
0 |
0 |
0.000 |
8 |
10 |
|
B |
14 |
5 |
15202 |
x |
B |
x-1,y,z |
1_455 |
12 |
3 |
15202 |
138.7 |
-0.2 |
0.635 |
0 |
1 |
0 |
0.000 |
9 |
11 |
|
[ACT]C:1507 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
28 |
13 |
15006 |
130.9 |
-1.2 |
0.601 |
1 |
0 |
0 |
0.010 |
10 |
12 |
|
B |
14 |
4 |
15202 |
◊ |
A |
x-1,y,z |
1_455 |
12 |
3 |
15115 |
125.7 |
0.3 |
0.678 |
0 |
0 |
0 |
0.000 |
11 |
13 |
|
C |
14 |
3 |
15006 |
x |
C |
x-1,y,z |
1_455 |
11 |
4 |
15006 |
112.3 |
1.3 |
0.819 |
1 |
2 |
0 |
0.000 |
12 |
14 |
|
[ACT]C:1509 |
4 |
1 |
184 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
15006 |
102.1 |
-1.1 |
0.521 |
2 |
0 |
0 |
0.012 |
13 |
15 |
|
[ACT]B:1503 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
12 |
6 |
15202 |
98.2 |
-1.1 |
0.530 |
2 |
0 |
0 |
0.017 |
14 |
16 |
|
[ACT]C:1508 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
15 |
7 |
15006 |
96.2 |
-0.4 |
0.680 |
1 |
0 |
0 |
0.005 |
15 |
17 |
|
[ACT]B:1505 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
15202 |
93.9 |
-0.4 |
0.662 |
1 |
0 |
0 |
0.007 |
16 |
18 |
|
[ACT]C:1502 |
4 |
1 |
183 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
15006 |
80.1 |
-1.5 |
0.436 |
0 |
0 |
0 |
0.009 |
17 |
19 |
|
[ACT]A:1510 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
11 |
7 |
15115 |
78.7 |
-0.4 |
0.644 |
1 |
0 |
0 |
0.008 |
18 |
20 |
|
[TRS]A:1501 |
5 |
1 |
240 |
◊ |
C |
x,y,z |
1_555 |
10 |
5 |
15006 |
71.7 |
1.8 |
0.299 |
2 |
0 |
0 |
0.000 |
19 |
21 |
|
[TRS]A:1501 |
4 |
1 |
240 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
15115 |
71.4 |
1.8 |
0.448 |
2 |
0 |
0 |
0.000 |
20 |
22 |
|
[TRS]A:1501 |
4 |
1 |
240 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
15202 |
70.8 |
1.8 |
0.452 |
2 |
0 |
0 |
0.000 |
21 |
23 |
|
[ACT]B:1504 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
12 |
5 |
15202 |
69.8 |
0.1 |
0.697 |
0 |
0 |
0 |
0.000 |
22 |
24 |
|
[ACT]C:503 |
4 |
1 |
182 |
f |
C |
x,y,z |
1_555 |
13 |
6 |
15006 |
57.6 |
-0.9 |
0.527 |
1 |
0 |
0 |
0.008 |
23 |
25 |
|
A |
7 |
3 |
15115 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
6 |
3 |
15202 |
55.8 |
-0.1 |
0.611 |
0 |
0 |
0 |
0.000 |
24 |
26 |
|
[ACT]C:1502 |
4 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
15115 |
55.7 |
-0.8 |
0.419 |
0 |
0 |
0 |
0.005 |
25 |
27 |
|
[ACT]B:1504 |
3 |
1 |
184 |
f |
A |
x-1/2,-y-1/2,-z |
4_445 |
11 |
4 |
15115 |
55.5 |
-0.7 |
0.590 |
0 |
0 |
0 |
0.008 |
26 |
28 |
|
[N2O]B:503 |
3 |
1 |
155 |
◊ |
C |
x,y,z |
1_555 |
9 |
5 |
15006 |
53.7 |
-0.1 |
0.319 |
0 |
0 |
0 |
0.000 |
27 |
29 |
|
[ACT]C:503 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
15115 |
53.6 |
-0.5 |
0.473 |
1 |
0 |
0 |
0.006 |
28 |
30 |
|
[ACT]B:1505 |
3 |
1 |
183 |
◊ |
C |
x,y,z |
1_555 |
6 |
2 |
15006 |
53.4 |
-0.3 |
0.696 |
0 |
0 |
0 |
0.002 |
29 |
31 |
|
[N2O]A:503 |
3 |
1 |
154 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
15202 |
52.6 |
-0.1 |
0.324 |
0 |
0 |
0 |
0.000 |
30 |
32 |
|
[N2O]A:503 |
3 |
1 |
154 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
15115 |
50.1 |
0.0 |
0.403 |
0 |
0 |
0 |
0.000 |
31 |
33 |
|
[ACT]C:1508 |
3 |
1 |
183 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
15115 |
49.7 |
-0.1 |
0.705 |
0 |
0 |
0 |
0.000 |
32 |
34 |
|
[N2O]B:503 |
3 |
1 |
155 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
15202 |
49.2 |
0.1 |
0.406 |
1 |
0 |
0 |
0.003 |
33 |
35 |
|
A |
3 |
1 |
15115 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
7 |
2 |
15202 |
48.5 |
-0.9 |
0.215 |
0 |
0 |
0 |
0.000 |
34 |
36 |
|
[ACT]A:1510 |
3 |
1 |
182 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
15202 |
47.8 |
-0.3 |
0.671 |
0 |
0 |
0 |
0.002 |
35 |
37 |
|
[ACT]C:1506 |
3 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
10 |
4 |
15202 |
47.3 |
-1.2 |
0.479 |
0 |
0 |
0 |
0.010 |
36 |
38 |
|
[ACT]C:1506 |
3 |
1 |
182 |
◊ |
C |
x,y,z |
1_555 |
7 |
3 |
15006 |
41.4 |
-0.9 |
0.467 |
0 |
0 |
0 |
0.006 |
37 |
39 |
|
[ACT]C:1506 |
4 |
1 |
182 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
15115 |
37.4 |
-0.4 |
0.537 |
0 |
0 |
0 |
0.002 |
38 |
40 |
|
[CU]C:502 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
5 |
15006 |
36.4 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.098 |
41 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
15115 |
36.1 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.098 |
42 |
|
[CU]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
5 |
15202 |
36.1 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.098 |
Average: |
36.2 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.098 |
39 |
43 |
|
[CU]A:502 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
9 |
4 |
15202 |
36.2 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.085 |
44 |
|
[CU]B:502 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
9 |
4 |
15006 |
35.8 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.085 |
45 |
|
[CU]C:502 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
9 |
4 |
15115 |
35.3 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.085 |
Average: |
35.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.085 |
40 |
46 |
|
B |
5 |
2 |
15202 |
◊ |
[ACT]A:1510 |
x-1/2,-y-1/2,-z |
4_445 |
1 |
1 |
182 |
34.4 |
-0.6 |
0.377 |
0 |
0 |
0 |
0.000 |
41 |
47 |
|
[N2O]B:503 |
3 |
1 |
155 |
f |
[CU]B:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
28.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.034 |
48 |
|
[N2O]A:503 |
3 |
1 |
154 |
f |
[CU]A:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
27.0 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.034 |
Average: |
27.7 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.034 |
42 |
49 |
|
[ACT]C:503 |
3 |
1 |
182 |
f |
[CU]C:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
26.3 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.017 |
43 |
50 |
|
[ACT]C:503 |
1 |
1 |
182 |
f |
[ACT]C:1502 |
x,y,z |
1_555 |
1 |
1 |
183 |
23.8 |
-0.8 |
0.250 |
0 |
0 |
0 |
0.005 |
44 |
51 |
|
A |
3 |
2 |
15115 |
x |
A |
x-1,y,z |
1_455 |
1 |
1 |
15115 |
9.9 |
-0.3 |
0.322 |
0 |
0 |
0 |
0.000 |
45 |
52 |
|
B |
1 |
1 |
15202 |
◊ |
C |
-x+1,y-1/2,-z-1/2 |
3_644 |
2 |
1 |
15006 |
3.2 |
-0.1 |
0.457 |
0 |
0 |
0 |
0.000 |
|