## |
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 |
|
F |
149 |
40 |
14358 |
◊ |
E |
x,y,z |
1_555 |
148 |
45 |
13773 |
1405.9 |
-10.2 |
0.261 |
21 |
13 |
0 |
0.430 |
2 |
|
C |
137 |
42 |
13662 |
◊ |
A |
x,y,z |
1_555 |
139 |
39 |
13814 |
1329.0 |
-7.8 |
0.337 |
20 |
14 |
0 |
0.430 |
3 |
|
B |
141 |
41 |
13829 |
◊ |
A |
x,y,z |
1_555 |
142 |
44 |
13814 |
1327.6 |
-8.8 |
0.313 |
21 |
12 |
0 |
0.430 |
4 |
|
E |
135 |
35 |
13773 |
◊ |
D |
x,y,z |
1_555 |
134 |
43 |
14023 |
1312.1 |
-6.0 |
0.448 |
24 |
12 |
0 |
0.430 |
5 |
|
F |
130 |
41 |
14358 |
◊ |
D |
x,y,z |
1_555 |
137 |
36 |
14023 |
1282.2 |
-8.0 |
0.333 |
21 |
12 |
0 |
0.430 |
6 |
|
C |
130 |
36 |
13662 |
◊ |
B |
x,y,z |
1_555 |
139 |
42 |
13829 |
1265.9 |
-7.8 |
0.359 |
21 |
12 |
0 |
0.430 |
Average: |
1320.4 |
-8.1 |
0.342 |
21 |
13 |
0 |
0.430 |
2 |
7 |
|
A |
69 |
21 |
13814 |
◊ |
D |
x,y,z-1 |
1_554 |
73 |
20 |
14023 |
659.1 |
-4.6 |
0.334 |
7 |
1 |
0 |
0.000 |
3 |
8 |
|
B |
72 |
26 |
13829 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
82 |
22 |
14358 |
658.2 |
-3.2 |
0.487 |
9 |
4 |
0 |
0.000 |
4 |
9 |
|
C |
50 |
16 |
13662 |
◊ |
A |
-x+1,y-1/2,-z+1 |
2_646 |
51 |
15 |
13814 |
475.6 |
-0.7 |
0.571 |
7 |
4 |
0 |
0.000 |
5 |
10 |
|
E |
36 |
13 |
13773 |
◊ |
D |
-x+1,y-1/2,-z+2 |
2_647 |
39 |
13 |
14023 |
308.9 |
0.7 |
0.709 |
6 |
8 |
0 |
0.000 |
6 |
11 |
|
F |
24 |
7 |
14358 |
◊ |
C |
x,y,z |
1_555 |
24 |
9 |
13662 |
216.6 |
-2.5 |
0.269 |
0 |
0 |
0 |
0.000 |
7 |
12 |
|
B |
23 |
8 |
13829 |
◊ |
D |
-x,y-1/2,-z+1 |
2_546 |
24 |
8 |
14023 |
213.1 |
-3.0 |
0.239 |
2 |
0 |
0 |
0.000 |
8 |
13 |
|
B |
26 |
9 |
13829 |
◊ |
D |
x,y,z-1 |
1_554 |
22 |
8 |
14023 |
212.4 |
1.2 |
0.773 |
2 |
1 |
0 |
0.000 |
9 |
14 |
|
C |
22 |
9 |
13662 |
◊ |
F |
-x,y-1/2,-z+1 |
2_546 |
19 |
6 |
14358 |
145.7 |
0.8 |
0.713 |
0 |
0 |
0 |
0.000 |
10 |
15 |
|
E |
17 |
6 |
13773 |
◊ |
C |
x,y,z |
1_555 |
13 |
5 |
13662 |
124.7 |
-1.4 |
0.329 |
1 |
0 |
0 |
0.000 |
11 |
16 |
|
A |
11 |
3 |
13814 |
◊ |
F |
-x+1,y-1/2,-z+1 |
2_646 |
10 |
3 |
14358 |
91.4 |
0.5 |
0.711 |
1 |
2 |
0 |
0.000 |
12 |
17 |
|
F |
7 |
2 |
14358 |
◊ |
A |
x,y,z |
1_555 |
4 |
3 |
13814 |
58.6 |
1.3 |
0.829 |
1 |
2 |
0 |
0.000 |
13 |
18 |
|
[CL]B:602 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
5 |
13662 |
45.8 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.131 |
19 |
|
[CL]D:604 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
11 |
5 |
13773 |
45.5 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.131 |
20 |
|
[CL]C:603 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
13814 |
44.6 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.131 |
21 |
|
[CL]F:605 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
9 |
4 |
14358 |
44.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.131 |
22 |
|
[CL]F:606 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
9 |
4 |
14023 |
44.4 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.131 |
23 |
|
[CL]B:601 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
13829 |
44.4 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.131 |
Average: |
44.9 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.131 |
14 |
24 |
|
A |
6 |
3 |
13814 |
◊ |
E |
x,y,z-1 |
1_554 |
9 |
4 |
13773 |
45.3 |
-1.3 |
0.239 |
0 |
0 |
0 |
0.000 |
15 |
25 |
|
[CU]A:502 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
13829 |
39.0 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.105 |
26 |
|
[CU]E:502 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
10 |
4 |
14358 |
38.8 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.105 |
27 |
|
[CU]B:502 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
11 |
4 |
13662 |
38.8 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.105 |
28 |
|
[CU]F:502 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
10 |
4 |
14023 |
38.2 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.105 |
29 |
|
[CU]D:502 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
11 |
4 |
13773 |
37.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.105 |
30 |
|
[CU]C:502 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
13814 |
37.3 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.105 |
Average: |
38.3 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.105 |
16 |
31 |
|
[CU]B:502 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
5 |
13829 |
38.9 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.127 |
32 |
|
[CU]C:502 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
9 |
5 |
13662 |
38.5 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.127 |
33 |
|
[CU]D:502 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
7 |
5 |
14023 |
38.4 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.127 |
34 |
|
[CU]F:502 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
7 |
5 |
14358 |
37.8 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.127 |
35 |
|
[CU]A:502 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
13814 |
37.7 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.127 |
36 |
|
[CU]E:502 |
1 |
1 |
125 |
cf |
E |
x,y,z |
1_555 |
9 |
5 |
13773 |
37.3 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.127 |
Average: |
38.1 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.127 |
17 |
37 |
|
[CL]B:602 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
13829 |
36.6 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
38 |
|
[CL]B:601 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
8 |
4 |
13814 |
36.0 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
39 |
|
[CL]D:604 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
8 |
4 |
14023 |
34.4 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.100 |
40 |
|
[CL]F:606 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
9 |
6 |
14358 |
34.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.100 |
41 |
|
[CL]F:605 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
9 |
4 |
13773 |
33.7 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
42 |
|
[CL]C:603 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
13662 |
33.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.100 |
Average: |
34.8 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.100 |
18 |
43 |
|
[CL]D:604 |
1 |
1 |
125 |
◊ |
[CU]D:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.9 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.038 |
19 |
44 |
|
[CL]F:605 |
1 |
1 |
125 |
◊ |
[CU]E:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.6 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.037 |
20 |
45 |
|
[CL]B:602 |
1 |
1 |
125 |
◊ |
[CU]B:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.5 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.038 |
21 |
46 |
|
[CL]F:606 |
1 |
1 |
125 |
◊ |
[CU]F:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.4 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.037 |
22 |
47 |
|
[CL]B:601 |
1 |
1 |
125 |
◊ |
[CU]A:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.3 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.037 |
23 |
48 |
|
[CL]C:603 |
1 |
1 |
125 |
◊ |
[CU]C:502 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.3 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.037 |
|