| ## |
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 |
359 |
98 |
16806 |
◊ |
A |
x,y,z |
1_555 |
355 |
94 |
17075 |
3322.8 |
-10.8 |
0.648 |
75 |
21 |
0 |
0.586 |
2 |
|
C |
347 |
96 |
16356 |
◊ |
B |
x,y,z |
1_555 |
336 |
91 |
16277 |
3211.6 |
-10.7 |
0.672 |
67 |
21 |
0 |
0.586 |
| Average: |
3267.2 |
-10.7 |
0.660 |
71 |
21 |
0 |
0.586 |
| 2 |
3 |
|
B |
76 |
19 |
16277 |
◊ |
A |
x,y,z |
1_555 |
76 |
19 |
17075 |
688.3 |
-8.6 |
0.161 |
6 |
4 |
0 |
0.113 |
4 |
|
D |
74 |
19 |
16806 |
◊ |
C |
x,y,z |
1_555 |
75 |
19 |
16356 |
686.6 |
-8.5 |
0.150 |
6 |
4 |
0 |
0.113 |
| Average: |
687.5 |
-8.5 |
0.156 |
6 |
4 |
0 |
0.113 |
| 3 |
5 |
|
[COA]C:501 |
37 |
1 |
997 |
f |
C |
x,y,z |
1_555 |
54 |
25 |
16356 |
529.4 |
3.3 |
0.323 |
6 |
0 |
0 |
0.000 |
| 4 |
6 |
|
[COA]D:501 |
36 |
1 |
987 |
f |
D |
x,y,z |
1_555 |
56 |
27 |
16806 |
524.7 |
3.7 |
0.388 |
7 |
0 |
0 |
0.001 |
7 |
|
[COA]B:501 |
37 |
1 |
987 |
f |
B |
x,y,z |
1_555 |
58 |
27 |
16277 |
522.9 |
4.4 |
0.462 |
7 |
0 |
0 |
0.001 |
8 |
|
[COA]A:1001 |
36 |
1 |
982 |
f |
A |
x,y,z |
1_555 |
55 |
27 |
17075 |
512.5 |
3.2 |
0.311 |
8 |
0 |
0 |
0.001 |
| Average: |
520.0 |
3.7 |
0.387 |
7 |
0 |
0 |
0.001 |
| 5 |
9 |
|
A |
51 |
17 |
17075 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
54 |
14 |
16806 |
487.8 |
-2.4 |
0.507 |
7 |
3 |
0 |
0.000 |
| 6 |
10 |
|
C |
44 |
11 |
16356 |
◊ |
A |
x,y,z |
1_555 |
47 |
11 |
17075 |
397.5 |
-8.5 |
0.036 |
2 |
0 |
0 |
0.089 |
11 |
|
D |
46 |
11 |
16806 |
◊ |
B |
x,y,z |
1_555 |
45 |
11 |
16277 |
396.5 |
-7.9 |
0.052 |
3 |
0 |
0 |
0.089 |
| Average: |
397.0 |
-8.2 |
0.044 |
3 |
0 |
0 |
0.089 |
| 7 |
12 |
|
C |
41 |
13 |
16356 |
◊ |
D |
-x+1/2,-y,z-1/2 |
2_554 |
47 |
17 |
16806 |
396.2 |
-2.9 |
0.382 |
4 |
4 |
0 |
0.000 |
| 8 |
13 |
|
C |
21 |
7 |
16356 |
◊ |
B |
-x-1/2,-y,z-1/2 |
2_454 |
23 |
7 |
16277 |
219.0 |
-0.6 |
0.496 |
2 |
0 |
0 |
0.000 |
| 9 |
14 |
|
[GOL]B:502 |
6 |
1 |
221 |
f |
B |
x,y,z |
1_555 |
24 |
11 |
16277 |
138.6 |
-0.6 |
0.570 |
8 |
0 |
0 |
0.143 |
15 |
|
[GOL]D:502 |
6 |
1 |
220 |
f |
D |
x,y,z |
1_555 |
25 |
10 |
16806 |
136.7 |
-0.6 |
0.567 |
7 |
0 |
0 |
0.143 |
| Average: |
137.7 |
-0.6 |
0.568 |
8 |
0 |
0 |
0.143 |
| 10 |
16 |
|
[GOL]C:502 |
6 |
1 |
221 |
f |
C |
x,y,z |
1_555 |
24 |
10 |
16356 |
136.9 |
-0.6 |
0.574 |
7 |
0 |
0 |
0.049 |
17 |
|
[GOL]A:1002 |
6 |
1 |
219 |
f |
A |
x,y,z |
1_555 |
26 |
11 |
17075 |
136.6 |
-0.6 |
0.574 |
8 |
0 |
0 |
0.049 |
| Average: |
136.8 |
-0.6 |
0.574 |
8 |
0 |
0 |
0.049 |
| 11 |
18 |
|
C |
12 |
5 |
16356 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
19 |
5 |
16277 |
123.6 |
-0.0 |
0.651 |
1 |
1 |
0 |
0.000 |
| 12 |
19 |
|
C |
15 |
5 |
16356 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
10 |
2 |
17075 |
112.0 |
-1.2 |
0.284 |
0 |
0 |
0 |
0.000 |
| 13 |
20 |
|
B |
16 |
6 |
16277 |
◊ |
A |
x-1,y,z |
1_455 |
15 |
5 |
17075 |
110.7 |
-0.5 |
0.477 |
1 |
1 |
0 |
0.000 |
| 14 |
21 |
|
B |
9 |
5 |
16277 |
◊ |
D |
x-1,y,z |
1_455 |
6 |
2 |
16806 |
82.0 |
0.3 |
0.691 |
1 |
2 |
0 |
0.000 |
| 15 |
22 |
|
[CL]D:503 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
6 |
16806 |
74.3 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.123 |
| 16 |
23 |
|
[CL]D:504 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
17075 |
72.9 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.123 |
24 |
|
[CL]B:503 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
17 |
9 |
16356 |
71.4 |
-9.1 |
0.000 |
0 |
0 |
0 |
0.123 |
| Average: |
72.1 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.123 |
| 17 |
25 |
|
[CL]A:1003 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
13 |
8 |
17075 |
65.2 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.125 |
| 18 |
26 |
|
[CL]C:503 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
7 |
6 |
16356 |
52.5 |
-8.8 |
0.000 |
0 |
0 |
0 |
0.118 |
| 19 |
27 |
|
[CL]C:503 |
1 |
1 |
125 |
f |
[COA]C:501 |
x,y,z |
1_555 |
4 |
1 |
997 |
36.4 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.041 |
| 20 |
28 |
|
[CL]B:503 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
1 |
16277 |
32.8 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.052 |
29 |
|
[CL]D:504 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
4 |
1 |
16806 |
32.6 |
-3.7 |
0.000 |
0 |
0 |
0 |
0.052 |
| Average: |
32.7 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.052 |
| 21 |
30 |
|
B |
14 |
5 |
16277 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
9 |
6 |
16806 |
31.1 |
-0.2 |
0.599 |
0 |
0 |
0 |
0.000 |
| 22 |
31 |
|
C |
2 |
1 |
16356 |
◊ |
A |
x-1,y,z |
1_455 |
2 |
2 |
17075 |
27.4 |
0.2 |
0.521 |
0 |
0 |
0 |
0.000 |
| 23 |
32 |
|
[CL]D:503 |
1 |
1 |
125 |
f |
[COA]D:501 |
x,y,z |
1_555 |
2 |
1 |
987 |
7.9 |
-0.7 |
0.000 |
0 |
0 |
0 |
0.007 |
| 24 |
33 |
|
[COA]A:1001 |
3 |
1 |
982 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
16277 |
6.9 |
0.1 |
0.568 |
0 |
0 |
0 |
0.000 |
34 |
|
[COA]B:501 |
1 |
1 |
987 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
17075 |
1.2 |
-0.0 |
0.564 |
0 |
0 |
0 |
0.000 |
| Average: |
4.1 |
0.0 |
0.566 |
0 |
0 |
0 |
0.000 |
| 25 |
35 |
|
[CL]A:1003 |
1 |
1 |
125 |
f |
[COA]A:1001 |
x,y,z |
1_555 |
1 |
1 |
982 |
6.8 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.010 |
| 26 |
36 |
|
[COA]B:501 |
3 |
1 |
987 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
16806 |
5.0 |
0.0 |
0.559 |
0 |
0 |
0 |
0.000 |
| 27 |
37 |
|
[CL]D:503 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
17075 |
4.1 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.004 |
| 28 |
38 |
|
[COA]C:501 |
2 |
1 |
997 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
16806 |
1.6 |
-0.0 |
0.516 |
0 |
0 |
0 |
0.000 |
|