| ## |
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 |
175 |
41 |
10671 |
◊ |
E |
x,y,z |
1_555 |
171 |
40 |
10476 |
1618.8 |
-23.9 |
0.020 |
11 |
8 |
0 |
0.671 |
2 |
|
D |
172 |
39 |
10565 |
◊ |
A |
x,y,z |
1_555 |
170 |
40 |
10567 |
1612.0 |
-24.3 |
0.019 |
13 |
8 |
0 |
0.671 |
3 |
|
C |
165 |
38 |
10585 |
◊ |
B |
x,y,z |
1_555 |
170 |
39 |
10819 |
1579.1 |
-24.9 |
0.013 |
11 |
8 |
0 |
0.671 |
| Average: |
1603.3 |
-24.3 |
0.018 |
12 |
8 |
0 |
0.671 |
| 2 |
4 |
|
D |
163 |
41 |
10565 |
◊ |
C |
x,y,z |
1_555 |
164 |
41 |
10585 |
1499.3 |
-16.3 |
0.143 |
14 |
10 |
0 |
0.626 |
5 |
|
F |
165 |
39 |
10671 |
◊ |
F |
x,-y,-z-1 |
4_554 |
165 |
39 |
10671 |
1487.6 |
-14.9 |
0.159 |
16 |
12 |
0 |
0.626 |
6 |
|
E |
163 |
39 |
10476 |
◊ |
E |
x,-y,-z-1 |
4_554 |
163 |
39 |
10476 |
1456.3 |
-17.2 |
0.112 |
14 |
10 |
0 |
0.626 |
7 |
|
B |
158 |
37 |
10819 |
◊ |
A |
x,y,z |
1_555 |
159 |
39 |
10567 |
1447.6 |
-18.1 |
0.080 |
13 |
10 |
0 |
0.626 |
| Average: |
1472.7 |
-16.6 |
0.124 |
14 |
11 |
0 |
0.626 |
| 3 |
8 |
|
E |
81 |
20 |
10476 |
◊ |
B |
x,y,z |
1_555 |
57 |
17 |
10819 |
587.0 |
-7.1 |
0.192 |
3 |
7 |
0 |
0.112 |
| 4 |
9 |
|
D |
42 |
10 |
10565 |
◊ |
B |
x,y,z |
1_555 |
39 |
10 |
10819 |
364.6 |
2.6 |
0.880 |
6 |
0 |
0 |
0.004 |
10 |
|
F |
37 |
9 |
10671 |
◊ |
E |
x,-y,-z-1 |
4_554 |
36 |
10 |
10476 |
312.9 |
3.3 |
0.904 |
7 |
0 |
0 |
0.004 |
11 |
|
C |
31 |
8 |
10585 |
◊ |
A |
x,y,z |
1_555 |
33 |
9 |
10567 |
266.9 |
1.6 |
0.823 |
5 |
0 |
0 |
0.004 |
| Average: |
314.8 |
2.5 |
0.869 |
6 |
0 |
0 |
0.004 |
| 5 |
12 |
|
[MES]B:302 |
12 |
1 |
338 |
f |
B |
x,y,z |
1_555 |
38 |
12 |
10819 |
239.2 |
7.5 |
0.474 |
0 |
0 |
0 |
0.000 |
| 6 |
13 |
|
E |
26 |
7 |
10476 |
◊ |
B |
-x-1,y,-z-1/2 |
3_454 |
28 |
9 |
10819 |
236.6 |
1.4 |
0.783 |
3 |
1 |
0 |
0.000 |
| 7 |
14 |
|
C |
28 |
11 |
10585 |
◊ |
D |
x-1/2,-y+1/2,-z |
8_455 |
21 |
6 |
10565 |
215.8 |
1.4 |
0.764 |
4 |
4 |
0 |
0.000 |
| 8 |
15 |
|
C |
22 |
6 |
10585 |
◊ |
D |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
22 |
6 |
10565 |
179.1 |
-1.1 |
0.511 |
0 |
0 |
0 |
0.000 |
| 9 |
16 |
|
F |
15 |
5 |
10671 |
◊ |
F |
-x,y,-z-1/2 |
3_554 |
14 |
4 |
10671 |
150.8 |
2.1 |
0.874 |
2 |
4 |
0 |
0.000 |
| 10 |
17 |
|
C |
15 |
5 |
10585 |
◊ |
A |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
10 |
4 |
10567 |
118.5 |
-0.7 |
0.497 |
3 |
1 |
0 |
0.000 |
18 |
|
B |
10 |
4 |
10819 |
◊ |
D |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
14 |
5 |
10565 |
112.9 |
-0.6 |
0.519 |
3 |
1 |
0 |
0.000 |
| Average: |
115.7 |
-0.6 |
0.508 |
3 |
1 |
0 |
0.000 |
| 11 |
19 |
|
E |
13 |
5 |
10476 |
◊ |
E |
-x-1,y,-z-1/2 |
3_454 |
13 |
5 |
10476 |
112.5 |
-0.0 |
0.651 |
2 |
4 |
0 |
0.000 |
| 12 |
20 |
|
C |
10 |
4 |
10585 |
◊ |
C |
-x-1,y,-z-1/2 |
3_454 |
10 |
4 |
10585 |
99.8 |
0.8 |
0.782 |
0 |
0 |
0 |
0.000 |
| 13 |
21 |
|
A |
15 |
5 |
10567 |
◊ |
A |
x,-y,-z |
4_555 |
15 |
5 |
10567 |
94.5 |
1.9 |
0.874 |
0 |
0 |
0 |
0.000 |
| 14 |
22 |
|
F |
10 |
4 |
10671 |
◊ |
A |
-x,y,-z-1/2 |
3_554 |
12 |
4 |
10567 |
83.6 |
0.1 |
0.665 |
0 |
0 |
0 |
0.000 |
| 15 |
23 |
|
[CL]C:301 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
13 |
7 |
10585 |
71.3 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.560 |
24 |
|
[CL]B:301 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
10819 |
71.3 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.560 |
25 |
|
[CL]A:301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
7 |
10567 |
71.3 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.560 |
26 |
|
[CL]D:301 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
10565 |
71.0 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.560 |
27 |
|
[CL]E:302 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
13 |
7 |
10476 |
70.8 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.560 |
28 |
|
[CL]F:301 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
12 |
7 |
10671 |
70.8 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.560 |
| Average: |
71.1 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.560 |
| 16 |
29 |
|
F |
11 |
4 |
10671 |
◊ |
A |
x,-y,-z |
4_555 |
9 |
4 |
10567 |
62.3 |
-0.4 |
0.477 |
0 |
0 |
0 |
0.000 |
| 17 |
30 |
|
F |
9 |
3 |
10671 |
◊ |
A |
-x,-y,z-1/2 |
2_554 |
6 |
2 |
10567 |
57.4 |
1.2 |
0.840 |
0 |
0 |
0 |
0.000 |
| 18 |
31 |
|
F |
4 |
1 |
10671 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
10567 |
52.4 |
0.2 |
0.699 |
0 |
0 |
0 |
0.000 |
| 19 |
32 |
|
E |
4 |
2 |
10476 |
f |
[MG]E:301 |
-x-1,-y,z-1/2 |
2_454 |
1 |
1 |
98 |
35.4 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.133 |
| 20 |
33 |
|
[MG]E:304 |
1 |
1 |
98 |
x |
E |
x,y,z |
1_555 |
7 |
4 |
10476 |
35.0 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.000 |
| 21 |
34 |
|
F |
4 |
2 |
10671 |
◊ |
C |
-x-1/2,y-1/2,-z-1/2 |
7_444 |
6 |
2 |
10585 |
31.6 |
0.2 |
0.689 |
0 |
0 |
0 |
0.000 |
| 22 |
35 |
|
[MG]E:303 |
1 |
1 |
98 |
f |
E |
x,y,z |
1_555 |
5 |
2 |
10476 |
25.8 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.089 |
| 23 |
36 |
|
[MG]E:303 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
6 |
3 |
10567 |
22.0 |
-2.3 |
0.000 |
0 |
0 |
0 |
0.027 |
| 24 |
37 |
|
B |
3 |
1 |
10819 |
◊ |
B |
x,-y,-z |
4_555 |
3 |
1 |
10819 |
20.4 |
0.3 |
0.760 |
0 |
0 |
0 |
0.000 |
| 25 |
38 |
|
D |
3 |
1 |
10565 |
◊ |
D |
-x,y,-z-1/2 |
3_554 |
3 |
1 |
10565 |
18.2 |
0.4 |
0.799 |
0 |
0 |
0 |
0.000 |
| 26 |
39 |
|
[MG]E:301 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
10819 |
16.2 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 27 |
40 |
|
E |
3 |
2 |
10476 |
◊ |
B |
-x-1,-y,z-1/2 |
2_454 |
1 |
1 |
10819 |
14.1 |
0.5 |
0.862 |
0 |
0 |
0 |
0.000 |
| 28 |
41 |
|
[MG]E:303 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
10819 |
8.6 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.007 |
| 29 |
42 |
|
D |
1 |
1 |
10565 |
◊ |
C |
-x-1/2,-y+1/2,z-1/2 |
6_454 |
1 |
1 |
10585 |
3.6 |
0.1 |
0.563 |
0 |
0 |
0 |
0.000 |
|