## |
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 |
78 |
24 |
14928 |
◊ |
A |
x,y,z |
1_555 |
63 |
17 |
15159 |
672.8 |
-1.0 |
0.568 |
12 |
6 |
0 |
0.000 |
2 |
|
C |
74 |
22 |
14553 |
◊ |
B |
-x+2,y-1/2,-z-2 |
2_743 |
64 |
18 |
14928 |
618.4 |
-3.3 |
0.500 |
9 |
4 |
0 |
0.000 |
Average: |
645.6 |
-2.2 |
0.534 |
11 |
5 |
0 |
0.000 |
2 |
3 |
|
A |
41 |
14 |
15159 |
◊ |
B |
-x+2,y-1/2,-z-1 |
2_744 |
49 |
15 |
14928 |
449.9 |
-6.8 |
0.099 |
5 |
0 |
0 |
0.000 |
4 |
|
C |
46 |
13 |
14553 |
◊ |
B |
x,y,z |
1_555 |
37 |
13 |
14928 |
412.8 |
-6.4 |
0.089 |
5 |
0 |
0 |
0.000 |
Average: |
431.3 |
-6.6 |
0.094 |
5 |
0 |
0 |
0.000 |
3 |
5 |
|
[M7Y]A:404 |
22 |
1 |
554 |
f |
A |
x,y,z |
1_555 |
54 |
15 |
15159 |
338.4 |
1.7 |
0.119 |
1 |
0 |
0 |
0.000 |
6 |
|
[M7Y]B:404 |
21 |
1 |
554 |
f |
B |
x,y,z |
1_555 |
55 |
15 |
14928 |
336.4 |
1.3 |
0.117 |
2 |
0 |
0 |
0.000 |
7 |
|
[M7Y]C:404 |
23 |
1 |
553 |
f |
C |
x,y,z |
1_555 |
53 |
15 |
14553 |
335.0 |
1.4 |
0.086 |
1 |
0 |
0 |
0.000 |
Average: |
336.6 |
1.5 |
0.107 |
1 |
0 |
0 |
0.000 |
4 |
8 |
|
C |
38 |
8 |
14553 |
◊ |
B |
x,y,z-1 |
1_554 |
39 |
13 |
14928 |
325.0 |
-1.7 |
0.525 |
2 |
0 |
0 |
0.000 |
5 |
9 |
|
A |
26 |
8 |
15159 |
x |
A |
-x+3,y-1/2,-z-1 |
2_844 |
22 |
7 |
15159 |
220.2 |
-3.1 |
0.265 |
0 |
0 |
0 |
0.000 |
6 |
10 |
|
A |
15 |
7 |
15159 |
◊ |
B |
-x+3,y-1/2,-z-1 |
2_844 |
18 |
6 |
14928 |
143.4 |
-0.8 |
0.436 |
0 |
0 |
0 |
0.000 |
7 |
11 |
|
B |
15 |
6 |
14928 |
x |
B |
-x+2,y-1/2,-z-1 |
2_744 |
16 |
7 |
14928 |
135.1 |
-0.9 |
0.447 |
0 |
0 |
0 |
0.000 |
12 |
|
C |
11 |
3 |
14553 |
x |
C |
-x+2,y-1/2,-z-2 |
2_743 |
7 |
4 |
14553 |
92.5 |
0.5 |
0.513 |
1 |
0 |
0 |
0.000 |
Average: |
113.8 |
-0.2 |
0.480 |
1 |
0 |
0 |
0.000 |
8 |
13 |
|
[EDO]B:405 |
4 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
21 |
8 |
14928 |
117.5 |
3.5 |
0.506 |
1 |
0 |
0 |
0.000 |
9 |
14 |
|
[K]A:402 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
12 |
9 |
15159 |
111.4 |
-108.2 |
0.000 |
0 |
0 |
0 |
0.075 |
15 |
|
[K]B:402 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
11 |
8 |
14928 |
110.8 |
-108.2 |
0.000 |
0 |
0 |
0 |
0.075 |
16 |
|
[K]C:402 |
1 |
1 |
216 |
f |
C |
x,y,z |
1_555 |
11 |
8 |
14553 |
110.6 |
-108.2 |
0.000 |
0 |
0 |
0 |
0.075 |
Average: |
111.0 |
-108.2 |
0.000 |
0 |
0 |
0 |
0.075 |
10 |
17 |
|
[EDO]A:405 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
15159 |
91.9 |
2.0 |
0.258 |
5 |
0 |
0 |
0.000 |
11 |
18 |
|
[EDO]A:407 |
4 |
1 |
185 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
15159 |
90.4 |
2.5 |
0.462 |
1 |
0 |
0 |
0.000 |
12 |
19 |
|
[EDO]A:406 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
15159 |
74.0 |
1.0 |
0.730 |
1 |
0 |
0 |
0.000 |
13 |
20 |
|
A |
3 |
1 |
15159 |
◊ |
C |
-x+2,y-1/2,-z-2 |
2_743 |
9 |
3 |
14553 |
59.6 |
2.3 |
0.932 |
0 |
0 |
0 |
0.000 |
14 |
21 |
|
[EDO]A:405 |
4 |
1 |
185 |
◊ |
B |
-x+2,y-1/2,-z-1 |
2_744 |
6 |
3 |
14928 |
52.7 |
1.7 |
0.804 |
0 |
0 |
0 |
0.000 |
15 |
22 |
|
[EDO]A:406 |
4 |
1 |
184 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
14928 |
46.3 |
1.3 |
0.769 |
0 |
0 |
0 |
0.000 |
16 |
23 |
|
[ZN]A:401 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
15159 |
36.4 |
-25.3 |
0.000 |
0 |
0 |
0 |
0.018 |
24 |
|
[ZN]C:401 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
10 |
7 |
14553 |
35.6 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.018 |
25 |
|
[ZN]B:401 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
10 |
7 |
14928 |
35.5 |
-24.9 |
0.000 |
0 |
0 |
0 |
0.018 |
Average: |
35.8 |
-25.1 |
0.000 |
0 |
0 |
0 |
0.018 |
17 |
26 |
|
[M7Y]B:404 |
4 |
1 |
554 |
f |
[ZN]B:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.9 |
-13.9 |
0.000 |
0 |
0 |
0 |
0.010 |
27 |
|
[M7Y]A:404 |
4 |
1 |
554 |
f |
[ZN]A:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.8 |
-13.6 |
0.000 |
0 |
0 |
0 |
0.010 |
28 |
|
[M7Y]C:404 |
4 |
1 |
553 |
f |
[ZN]C:401 |
x,y,z |
1_555 |
1 |
1 |
98 |
31.6 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.010 |
Average: |
31.8 |
-13.7 |
0.000 |
0 |
0 |
0 |
0.010 |
18 |
29 |
|
[M7Y]A:404 |
3 |
1 |
554 |
◊ |
B |
x,y,z |
1_555 |
5 |
1 |
14928 |
24.4 |
1.3 |
0.588 |
0 |
0 |
0 |
0.000 |
30 |
|
C |
3 |
1 |
14553 |
◊ |
[M7Y]B:404 |
-x+2,y-1/2,-z-2 |
2_743 |
2 |
1 |
554 |
22.5 |
1.1 |
0.655 |
0 |
0 |
0 |
0.000 |
Average: |
23.5 |
1.2 |
0.622 |
0 |
0 |
0 |
0.000 |
19 |
31 |
|
C |
1 |
1 |
14553 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
15159 |
13.1 |
0.0 |
0.383 |
0 |
0 |
0 |
0.000 |
|