| ## |
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 |
|
C |
103 |
30 |
8164 |
◊ |
A |
x-1,y,z |
1_455 |
101 |
28 |
8318 |
950.1 |
-1.5 |
0.620 |
16 |
4 |
0 |
0.108 |
| 2 |
2 |
|
B |
73 |
21 |
7907 |
◊ |
A |
x,y,z |
1_555 |
76 |
20 |
8318 |
725.8 |
-9.7 |
0.113 |
17 |
0 |
0 |
0.223 |
3 |
|
D |
75 |
21 |
8184 |
◊ |
C |
x,y,z |
1_555 |
75 |
20 |
8164 |
725.4 |
-9.1 |
0.139 |
17 |
1 |
0 |
0.223 |
| Average: |
725.6 |
-9.4 |
0.126 |
17 |
1 |
0 |
0.223 |
| 3 |
4 |
|
C |
60 |
18 |
8164 |
◊ |
B |
x,y,z |
1_555 |
58 |
16 |
7907 |
570.9 |
-6.8 |
0.149 |
3 |
0 |
0 |
0.042 |
| 4 |
5 |
|
D |
65 |
19 |
8184 |
◊ |
A |
x,y,z |
1_555 |
60 |
18 |
8318 |
556.3 |
-8.3 |
0.113 |
3 |
0 |
0 |
0.049 |
| 5 |
6 |
|
A |
54 |
13 |
8318 |
◊ |
D |
-x+3/2,-y,z-1/2 |
2_654 |
49 |
14 |
8184 |
460.1 |
-4.4 |
0.269 |
2 |
1 |
0 |
0.031 |
| 6 |
7 |
|
D |
51 |
12 |
8184 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
45 |
12 |
7907 |
408.3 |
-2.9 |
0.359 |
2 |
0 |
0 |
0.030 |
| 7 |
8 |
|
D |
26 |
8 |
8184 |
◊ |
B |
x,y,z |
1_555 |
25 |
8 |
7907 |
268.3 |
-4.4 |
0.127 |
1 |
0 |
0 |
0.025 |
| 8 |
9 |
|
B |
34 |
10 |
7907 |
◊ |
D |
x-1,y,z |
1_455 |
29 |
11 |
8184 |
265.6 |
-0.4 |
0.543 |
2 |
2 |
0 |
0.000 |
| 9 |
10 |
|
C |
22 |
8 |
8164 |
◊ |
A |
x,y,z |
1_555 |
23 |
8 |
8318 |
232.3 |
-3.7 |
0.173 |
2 |
0 |
0 |
0.024 |
| 10 |
11 |
|
B |
30 |
10 |
7907 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
23 |
7 |
8318 |
229.3 |
-1.7 |
0.421 |
2 |
0 |
0 |
0.001 |
| 11 |
12 |
|
A |
21 |
5 |
8318 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
29 |
10 |
8184 |
207.3 |
2.8 |
0.829 |
4 |
0 |
0 |
0.000 |
| 12 |
13 |
|
C |
24 |
5 |
8164 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
26 |
8 |
8184 |
181.2 |
0.2 |
0.623 |
1 |
0 |
0 |
0.000 |
| 13 |
14 |
|
C |
9 |
3 |
8164 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
17 |
6 |
8184 |
135.6 |
2.4 |
0.830 |
4 |
4 |
0 |
0.000 |
| 14 |
15 |
|
C |
14 |
6 |
8164 |
◊ |
D |
x-1,y,z |
1_455 |
15 |
7 |
8184 |
131.5 |
0.5 |
0.634 |
0 |
1 |
0 |
0.000 |
| 15 |
16 |
|
C |
10 |
5 |
8164 |
x |
C |
x-1/2,-y-1/2,-z |
4_445 |
7 |
2 |
8164 |
91.4 |
1.1 |
0.777 |
0 |
1 |
0 |
0.000 |
| 16 |
17 |
|
[CL]D:302 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
10 |
6 |
8184 |
78.2 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.274 |
18 |
|
[CL]A:303 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
6 |
8318 |
77.6 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.274 |
19 |
|
[CL]C:303 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
8164 |
76.7 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.274 |
| Average: |
77.5 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.274 |
| 17 |
20 |
|
C |
12 |
3 |
8164 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
5 |
1 |
7907 |
74.5 |
0.9 |
0.607 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[CL]D:301 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
13 |
6 |
8184 |
73.1 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.297 |
22 |
|
[CL]A:302 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
8318 |
73.0 |
-11.7 |
0.000 |
0 |
0 |
0 |
0.297 |
23 |
|
[CL]B:301 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
7907 |
72.5 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.297 |
24 |
|
[CL]C:302 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
6 |
8164 |
72.5 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.297 |
| Average: |
72.8 |
-11.5 |
0.000 |
0 |
0 |
0 |
0.297 |
| 19 |
25 |
|
[CL]A:304 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
11 |
4 |
8318 |
63.0 |
-8.9 |
0.000 |
0 |
0 |
0 |
0.115 |
| 20 |
26 |
|
[NA]D:306 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
13 |
7 |
8184 |
60.1 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.149 |
27 |
|
[NA]B:302 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
7907 |
54.1 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.149 |
| Average: |
57.1 |
-9.4 |
0.000 |
0 |
0 |
0 |
0.149 |
| 21 |
28 |
|
[CL]A:301 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
8 |
3 |
8318 |
54.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.094 |
| 22 |
29 |
|
[CL]C:301 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
11 |
3 |
8164 |
53.1 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.075 |
| 23 |
30 |
|
[CL]D:303 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
16 |
8 |
8184 |
50.5 |
-7.0 |
0.000 |
0 |
0 |
0 |
0.113 |
31 |
|
[CL]D:304 |
1 |
1 |
125 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
12 |
6 |
7907 |
50.5 |
-7.3 |
0.000 |
0 |
0 |
0 |
0.113 |
| Average: |
50.5 |
-7.2 |
0.000 |
0 |
0 |
0 |
0.113 |
| 24 |
32 |
|
[NA]D:305 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
10 |
4 |
8184 |
47.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.056 |
| 25 |
33 |
|
[CL]C:301 |
1 |
1 |
125 |
◊ |
A |
x-1,y,z |
1_455 |
8 |
3 |
8318 |
46.9 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.068 |
| 26 |
34 |
|
[CL]A:301 |
1 |
1 |
125 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
2 |
8184 |
43.4 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.003 |
| 27 |
35 |
|
C |
3 |
1 |
8164 |
◊ |
B |
-x-1,y-1/2,-z+1/2 |
3_445 |
8 |
4 |
7907 |
38.7 |
1.6 |
0.758 |
1 |
1 |
0 |
0.000 |
| 28 |
36 |
|
[CL]D:304 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
4 |
3 |
8184 |
30.5 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.032 |
| 29 |
37 |
|
C |
5 |
1 |
8164 |
◊ |
[NA]D:305 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
125 |
27.8 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.022 |
| 30 |
38 |
|
A |
4 |
2 |
8318 |
◊ |
[NA]D:305 |
-x+3/2,-y,z-1/2 |
2_654 |
1 |
1 |
125 |
27.3 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.016 |
| 31 |
39 |
|
[NA]D:306 |
1 |
1 |
125 |
◊ |
[CL]D:303 |
x,y,z |
1_555 |
1 |
1 |
125 |
25.2 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.040 |
| 32 |
40 |
|
[CL]D:304 |
1 |
1 |
125 |
◊ |
[NA]B:302 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
125 |
23.2 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.037 |
| 33 |
41 |
|
C |
2 |
1 |
8164 |
f |
[CL]D:303 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
125 |
18.0 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.010 |
| 34 |
42 |
|
[NA]D:305 |
1 |
1 |
125 |
◊ |
[CL]D:303 |
x,y,z |
1_555 |
1 |
1 |
125 |
17.5 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.028 |
| 35 |
43 |
|
[CL]C:302 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
7907 |
6.8 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.009 |
44 |
|
[CL]B:301 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
2 |
1 |
8164 |
6.3 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.009 |
45 |
|
[CL]A:302 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
8184 |
4.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
46 |
|
[CL]D:301 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
2 |
1 |
8318 |
3.9 |
-0.3 |
0.000 |
0 |
0 |
0 |
0.009 |
| Average: |
5.5 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.009 |
| 36 |
47 |
|
D |
1 |
1 |
8184 |
◊ |
[NA]B:302 |
-x,y-1/2,-z+1/2 |
3_545 |
1 |
1 |
125 |
6.4 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.004 |
| 37 |
48 |
|
B |
2 |
1 |
7907 |
◊ |
A |
x-3/2,-y+1/2,-z |
4_355 |
1 |
1 |
8318 |
5.2 |
0.3 |
0.791 |
0 |
0 |
0 |
0.000 |
| 38 |
49 |
|
[NA]D:306 |
1 |
1 |
125 |
f |
[NA]D:305 |
x,y,z |
1_555 |
1 |
1 |
125 |
2.7 |
-0.5 |
0.000 |
0 |
0 |
0 |
0.006 |
|