| ## |
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 |
64 |
18 |
7500 |
◊ |
L |
x-1,y-1,z |
1_445 |
67 |
20 |
6612 |
631.1 |
-4.6 |
0.548 |
6 |
0 |
0 |
0.081 |
2 |
|
G |
66 |
20 |
7171 |
◊ |
C |
x,y-1,z |
1_545 |
63 |
18 |
7246 |
618.3 |
-5.8 |
0.453 |
7 |
0 |
0 |
0.081 |
3 |
|
A |
60 |
18 |
7459 |
◊ |
E |
x-1,y,z |
1_455 |
63 |
18 |
6635 |
568.8 |
-6.0 |
0.442 |
3 |
0 |
0 |
0.081 |
4 |
|
F |
54 |
18 |
6162 |
◊ |
D |
x-1,y-1,z |
1_445 |
62 |
19 |
7107 |
556.9 |
-8.0 |
0.375 |
5 |
0 |
0 |
0.081 |
| Average: |
593.8 |
-6.1 |
0.454 |
5 |
0 |
0 |
0.081 |
| 2 |
5 |
|
E |
68 |
21 |
6635 |
◊ |
A |
x,y,z |
1_555 |
64 |
18 |
7459 |
611.3 |
0.6 |
0.900 |
16 |
0 |
0 |
0.412 |
6 |
|
G |
69 |
19 |
7171 |
◊ |
C |
x,y,z |
1_555 |
62 |
18 |
7246 |
587.9 |
-0.1 |
0.851 |
12 |
0 |
0 |
0.412 |
7 |
|
F |
58 |
19 |
6162 |
◊ |
D |
x,y,z |
1_555 |
59 |
16 |
7107 |
504.7 |
-2.0 |
0.836 |
9 |
0 |
0 |
0.412 |
8 |
|
L |
59 |
22 |
6612 |
◊ |
B |
x,y,z |
1_555 |
50 |
15 |
7500 |
503.6 |
-0.7 |
0.788 |
6 |
0 |
0 |
0.412 |
| Average: |
551.9 |
-0.5 |
0.844 |
11 |
0 |
0 |
0.412 |
| 3 |
9 |
|
D |
45 |
13 |
7107 |
◊ |
A |
x-1,y-1,z |
1_445 |
45 |
14 |
7459 |
468.9 |
-3.7 |
0.465 |
3 |
0 |
0 |
0.119 |
10 |
|
C |
43 |
13 |
7246 |
◊ |
B |
x-1,y-1,z |
1_445 |
42 |
13 |
7500 |
446.5 |
-2.5 |
0.562 |
6 |
0 |
0 |
0.119 |
| Average: |
457.7 |
-3.1 |
0.513 |
5 |
0 |
0 |
0.119 |
| 4 |
11 |
|
G |
18 |
6 |
7171 |
◊ |
E |
x-1,y-1,z |
1_445 |
17 |
7 |
6635 |
177.2 |
-3.0 |
0.277 |
1 |
0 |
0 |
0.054 |
12 |
|
L |
10 |
4 |
6612 |
◊ |
F |
-y,x-y,z-1/3 |
2_554 |
11 |
5 |
6162 |
95.3 |
-2.1 |
0.364 |
0 |
0 |
0 |
0.054 |
| Average: |
136.3 |
-2.5 |
0.320 |
1 |
0 |
0 |
0.054 |
| 5 |
13 |
|
L |
16 |
6 |
6612 |
◊ |
F |
-y,x-y-1,z-1/3 |
2_544 |
18 |
6 |
6162 |
164.6 |
-0.8 |
0.715 |
1 |
0 |
0 |
0.030 |
14 |
|
G |
16 |
6 |
7171 |
◊ |
E |
x,y,z |
1_555 |
16 |
5 |
6635 |
149.9 |
-0.0 |
0.718 |
1 |
0 |
0 |
0.030 |
| Average: |
157.2 |
-0.4 |
0.717 |
1 |
0 |
0 |
0.030 |
| 6 |
15 |
|
L |
16 |
9 |
6612 |
◊ |
D |
-y,x-y-1,z-1/3 |
2_544 |
10 |
5 |
7107 |
124.2 |
-1.1 |
0.502 |
1 |
0 |
0 |
0.085 |
16 |
|
B |
5 |
3 |
7500 |
◊ |
F |
-y,x-y-1,z-1/3 |
2_544 |
9 |
5 |
6162 |
77.4 |
-2.1 |
0.200 |
0 |
0 |
0 |
0.085 |
17 |
|
G |
10 |
7 |
7171 |
◊ |
A |
x,y,z |
1_555 |
12 |
6 |
7459 |
71.1 |
-1.1 |
0.466 |
0 |
0 |
0 |
0.085 |
18 |
|
E |
12 |
5 |
6635 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
7246 |
62.5 |
-1.0 |
0.460 |
0 |
0 |
0 |
0.085 |
| Average: |
83.8 |
-1.3 |
0.407 |
0 |
0 |
0 |
0.085 |
| 7 |
19 |
|
C |
6 |
2 |
7246 |
◊ |
B |
x-1,y,z |
1_455 |
7 |
2 |
7500 |
51.6 |
-0.2 |
0.523 |
0 |
0 |
0 |
0.000 |
20 |
|
D |
5 |
2 |
7107 |
◊ |
A |
x,y,z |
1_555 |
8 |
2 |
7459 |
51.1 |
-0.0 |
0.620 |
0 |
0 |
0 |
0.000 |
21 |
|
C |
5 |
2 |
7246 |
◊ |
B |
x,y,z |
1_555 |
6 |
2 |
7500 |
46.3 |
0.4 |
0.715 |
1 |
0 |
0 |
0.000 |
| Average: |
49.7 |
0.1 |
0.619 |
0 |
0 |
0 |
0.000 |
| 8 |
22 |
|
[CL]B:201 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
5 |
2 |
7500 |
48.1 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.298 |
23 |
|
[CL]C:202 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
8 |
2 |
7246 |
43.5 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.298 |
24 |
|
[CL]D:201 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
7 |
2 |
7107 |
31.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.298 |
| Average: |
41.1 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.298 |
| 9 |
25 |
|
[MG]C:201 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
7246 |
41.6 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.588 |
26 |
|
[MG]F:201 |
1 |
1 |
98 |
◊ |
F |
x,y,z |
1_555 |
6 |
4 |
6162 |
41.0 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.588 |
27 |
|
[MG]L:201 |
1 |
1 |
98 |
◊ |
L |
x,y,z |
1_555 |
7 |
4 |
6612 |
40.7 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.588 |
28 |
|
[MG]A:201 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
7 |
4 |
7459 |
40.7 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.588 |
29 |
|
[MG]A:201 |
1 |
1 |
98 |
◊ |
E |
x,y,z |
1_555 |
7 |
3 |
6635 |
35.3 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.588 |
30 |
|
[MG]L:201 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
7500 |
34.4 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.588 |
31 |
|
[MG]C:201 |
1 |
1 |
98 |
◊ |
G |
x,y,z |
1_555 |
6 |
3 |
7171 |
34.0 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.588 |
32 |
|
[MG]F:201 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
7107 |
33.6 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.588 |
| Average: |
37.7 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.588 |
| 10 |
33 |
|
B |
3 |
1 |
7500 |
◊ |
F |
-y-1,x-y-1,z-1/3 |
2_444 |
2 |
1 |
6162 |
29.1 |
-0.1 |
0.468 |
0 |
0 |
0 |
0.000 |
34 |
|
L |
2 |
1 |
6612 |
◊ |
D |
-y+1,x-y,z-1/3 |
2_654 |
3 |
1 |
7107 |
27.1 |
-0.0 |
0.450 |
0 |
0 |
0 |
0.000 |
35 |
|
G |
2 |
1 |
7171 |
◊ |
A |
x,y-1,z |
1_545 |
3 |
1 |
7459 |
15.8 |
-0.2 |
0.496 |
0 |
0 |
0 |
0.000 |
36 |
|
C |
2 |
1 |
7246 |
◊ |
E |
x-1,y,z |
1_455 |
1 |
1 |
6635 |
11.1 |
-0.4 |
0.270 |
0 |
0 |
0 |
0.000 |
| Average: |
20.8 |
-0.2 |
0.421 |
0 |
0 |
0 |
0.000 |
| 11 |
37 |
|
[CL]D:201 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
1 |
1 |
6162 |
7.6 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.047 |
38 |
|
[CL]B:201 |
1 |
1 |
125 |
◊ |
L |
x,y,z |
1_555 |
4 |
2 |
6612 |
4.5 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.047 |
| Average: |
6.1 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.047 |
| 12 |
39 |
|
C |
2 |
1 |
7246 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
7459 |
4.4 |
-0.1 |
0.461 |
0 |
0 |
0 |
0.000 |
|