| ## |
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 |
|
D |
101 |
26 |
11884 |
◊ |
C |
x,y,z |
1_555 |
99 |
25 |
11983 |
965.2 |
-9.6 |
0.271 |
8 |
12 |
0 |
0.241 |
2 |
|
B |
99 |
24 |
11869 |
◊ |
A |
x,y,z |
1_555 |
96 |
24 |
11992 |
951.8 |
-9.7 |
0.241 |
10 |
12 |
0 |
0.241 |
| Average: |
958.5 |
-9.6 |
0.256 |
9 |
12 |
0 |
0.241 |
| 2 |
3 |
|
D |
55 |
15 |
11884 |
◊ |
A |
-x-1/2,-y+1,z-1/2 |
2_464 |
55 |
16 |
11992 |
581.0 |
-6.9 |
0.187 |
0 |
0 |
0 |
0.000 |
4 |
|
C |
61 |
16 |
11983 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
55 |
15 |
11869 |
523.0 |
-7.9 |
0.163 |
0 |
3 |
0 |
0.000 |
| Average: |
552.0 |
-7.4 |
0.175 |
0 |
2 |
0 |
0.000 |
| 3 |
5 |
|
C |
48 |
14 |
11983 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
54 |
17 |
11884 |
458.0 |
0.5 |
0.751 |
1 |
4 |
0 |
0.000 |
6 |
|
C |
48 |
17 |
11983 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
41 |
14 |
11884 |
364.1 |
1.0 |
0.756 |
1 |
3 |
0 |
0.000 |
| Average: |
411.0 |
0.7 |
0.753 |
1 |
4 |
0 |
0.000 |
| 4 |
7 |
|
D |
53 |
20 |
11884 |
◊ |
A |
x,y,z |
1_555 |
52 |
19 |
11992 |
453.5 |
3.6 |
0.900 |
2 |
8 |
0 |
0.000 |
8 |
|
C |
55 |
19 |
11983 |
◊ |
B |
x,y,z |
1_555 |
48 |
21 |
11869 |
423.4 |
3.6 |
0.921 |
1 |
5 |
0 |
0.000 |
| Average: |
438.4 |
3.6 |
0.911 |
2 |
7 |
0 |
0.000 |
| 5 |
9 |
|
B |
21 |
6 |
11869 |
◊ |
D |
-x,y-1/2,-z-1/2 |
3_544 |
26 |
7 |
11884 |
168.9 |
-1.9 |
0.355 |
1 |
2 |
0 |
0.000 |
10 |
|
C |
20 |
7 |
11983 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
15 |
6 |
11992 |
149.9 |
0.1 |
0.679 |
1 |
2 |
0 |
0.000 |
| Average: |
159.4 |
-0.9 |
0.517 |
1 |
2 |
0 |
0.000 |
| 6 |
11 |
|
B |
18 |
7 |
11869 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
17 |
6 |
11884 |
139.2 |
0.6 |
0.732 |
2 |
0 |
0 |
0.000 |
| 7 |
12 |
|
C |
15 |
6 |
11983 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
13 |
5 |
11992 |
112.9 |
-0.7 |
0.526 |
0 |
0 |
0 |
0.000 |
| 8 |
13 |
|
[CD]D:304 |
1 |
1 |
112 |
f |
D |
x,y,z |
1_555 |
10 |
5 |
11884 |
62.1 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.101 |
| 9 |
14 |
|
[CD]C:301 |
1 |
1 |
112 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
11983 |
56.8 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.090 |
15 |
|
[CD]A:303 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
7 |
4 |
11992 |
55.8 |
-5.4 |
0.000 |
0 |
0 |
0 |
0.090 |
| Average: |
56.3 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.090 |
| 10 |
16 |
|
[CD]A:301 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
11992 |
55.2 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.180 |
17 |
|
[CD]B:304 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
11869 |
53.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.180 |
18 |
|
[CD]D:303 |
1 |
1 |
112 |
f |
D |
x,y,z |
1_555 |
8 |
3 |
11884 |
49.8 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.180 |
19 |
|
[CD]C:302 |
1 |
1 |
112 |
f |
C |
x,y,z |
1_555 |
6 |
2 |
11983 |
49.8 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.180 |
| Average: |
52.0 |
-5.7 |
0.000 |
0 |
0 |
0 |
0.180 |
| 11 |
20 |
|
A |
8 |
3 |
11992 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
12 |
3 |
11869 |
54.3 |
-0.5 |
0.529 |
0 |
0 |
0 |
0.000 |
| 12 |
21 |
|
[CD]D:302 |
1 |
1 |
112 |
f |
D |
x,y,z |
1_555 |
9 |
5 |
11884 |
51.8 |
-6.3 |
0.000 |
0 |
0 |
0 |
0.201 |
22 |
|
[CD]B:306 |
1 |
1 |
112 |
f |
C |
x,y,z |
1_555 |
7 |
4 |
11983 |
50.0 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.201 |
23 |
|
[CD]B:301 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
6 |
5 |
11869 |
49.8 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.201 |
24 |
|
[CD]A:302 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
5 |
4 |
11992 |
47.3 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.201 |
| Average: |
49.8 |
-6.1 |
0.000 |
0 |
0 |
0 |
0.201 |
| 13 |
25 |
|
[CD]A:305 |
1 |
1 |
112 |
f |
D |
x,y,z |
1_555 |
7 |
4 |
11884 |
51.4 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.181 |
26 |
|
[CD]B:302 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
11869 |
49.9 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.181 |
27 |
|
[CD]B:303 |
1 |
1 |
112 |
f |
C |
x,y,z |
1_555 |
9 |
4 |
11983 |
47.5 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.181 |
28 |
|
[CD]D:301 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
8 |
4 |
11992 |
46.8 |
-4.9 |
0.000 |
0 |
0 |
0 |
0.181 |
| Average: |
48.9 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.181 |
| 14 |
29 |
|
[CD]A:304 |
1 |
1 |
112 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
11992 |
47.8 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.139 |
30 |
|
[CD]B:305 |
1 |
1 |
112 |
f |
B |
x,y,z |
1_555 |
8 |
4 |
11869 |
45.5 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.139 |
| Average: |
46.7 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.139 |
| 15 |
31 |
|
[CD]D:301 |
1 |
1 |
112 |
◊ |
D |
x,y,z |
1_555 |
6 |
4 |
11884 |
38.0 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.076 |
32 |
|
[CD]B:303 |
1 |
1 |
112 |
◊ |
B |
x,y,z |
1_555 |
6 |
4 |
11869 |
34.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.076 |
33 |
|
[CD]B:302 |
1 |
1 |
112 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
11983 |
33.1 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.076 |
34 |
|
[CD]A:305 |
1 |
1 |
112 |
◊ |
A |
x,y,z |
1_555 |
4 |
2 |
11992 |
32.7 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.076 |
| Average: |
34.6 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.076 |
| 16 |
35 |
|
B |
5 |
2 |
11869 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
4 |
3 |
11992 |
38.0 |
0.7 |
0.800 |
1 |
0 |
0 |
0.000 |
| 17 |
36 |
|
[CD]B:301 |
1 |
1 |
112 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
11983 |
33.4 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.065 |
37 |
|
[CD]A:302 |
1 |
1 |
112 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
11884 |
32.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.065 |
38 |
|
[CD]B:306 |
1 |
1 |
112 |
◊ |
B |
x,y,z |
1_555 |
5 |
2 |
11869 |
31.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.065 |
39 |
|
[CD]D:302 |
1 |
1 |
112 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
11992 |
27.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.065 |
| Average: |
31.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.065 |
| 18 |
40 |
|
C |
9 |
3 |
11983 |
◊ |
[CD]D:303 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
112 |
30.1 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 19 |
41 |
|
[CD]C:302 |
1 |
1 |
112 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
2 |
1 |
11884 |
22.3 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.000 |
| 20 |
42 |
|
[CD]A:304 |
1 |
1 |
112 |
f |
[CD]A:301 |
x,y,z |
1_555 |
1 |
1 |
112 |
18.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.042 |
| 21 |
43 |
|
C |
3 |
1 |
11983 |
◊ |
[CD]A:303 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
112 |
15.8 |
-1.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 22 |
44 |
|
[CD]B:305 |
1 |
1 |
112 |
f |
[CD]B:304 |
x,y,z |
1_555 |
1 |
1 |
112 |
12.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.028 |
| 23 |
45 |
|
C |
2 |
1 |
11983 |
◊ |
[CD]A:304 |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
112 |
10.8 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.000 |
46 |
|
A |
1 |
1 |
11992 |
◊ |
[CD]B:304 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
112 |
5.7 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
8.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.000 |
| 24 |
47 |
|
[CD]A:303 |
1 |
1 |
112 |
◊ |
D |
x,y,z |
1_555 |
4 |
3 |
11884 |
7.2 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.004 |
48 |
|
[CD]C:301 |
1 |
1 |
112 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
11869 |
1.9 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.004 |
| Average: |
4.6 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.004 |
| 25 |
49 |
|
D |
1 |
1 |
11884 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
11869 |
4.4 |
0.1 |
0.782 |
0 |
0 |
0 |
0.000 |
| 26 |
50 |
|
C |
1 |
1 |
11983 |
◊ |
[CD]D:302 |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
112 |
3.6 |
-0.2 |
0.000 |
0 |
0 |
0 |
0.000 |
51 |
|
[CD]B:306 |
1 |
1 |
112 |
◊ |
D |
-x-1,y-1/2,-z-1/2 |
3_444 |
1 |
1 |
11884 |
1.2 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| Average: |
2.4 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
| 27 |
52 |
|
[CD]D:304 |
1 |
1 |
112 |
f |
[CD]D:303 |
x,y,z |
1_555 |
1 |
1 |
112 |
2.2 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.006 |
|