| ## |
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 |
107 |
34 |
16573 |
◊ |
C |
x,y,z |
1_555 |
106 |
34 |
16576 |
1071.0 |
-11.3 |
0.122 |
8 |
2 |
0 |
0.385 |
2 |
|
F |
104 |
33 |
16565 |
◊ |
E |
x,y,z |
1_555 |
107 |
36 |
16577 |
1069.3 |
-11.5 |
0.117 |
8 |
2 |
0 |
0.385 |
3 |
|
H |
112 |
37 |
16454 |
◊ |
G |
x,y,z |
1_555 |
104 |
33 |
16568 |
1063.6 |
-11.4 |
0.125 |
8 |
2 |
0 |
0.385 |
4 |
|
L |
103 |
33 |
16686 |
◊ |
K |
x,y,z |
1_555 |
104 |
35 |
16533 |
1056.4 |
-10.0 |
0.180 |
8 |
2 |
0 |
0.385 |
5 |
|
B |
101 |
33 |
16623 |
◊ |
A |
x,y,z |
1_555 |
104 |
34 |
16590 |
1055.0 |
-11.2 |
0.118 |
8 |
2 |
0 |
0.385 |
6 |
|
J |
103 |
34 |
16700 |
◊ |
I |
x,y,z |
1_555 |
107 |
34 |
16518 |
1054.6 |
-9.8 |
0.190 |
8 |
2 |
0 |
0.385 |
| Average: |
1061.6 |
-10.8 |
0.142 |
8 |
2 |
0 |
0.385 |
| 2 |
7 |
|
L |
51 |
17 |
16686 |
◊ |
J |
x,y,z |
1_555 |
48 |
16 |
16700 |
501.0 |
2.2 |
0.842 |
7 |
2 |
0 |
0.000 |
8 |
|
D |
50 |
17 |
16573 |
◊ |
B |
x,y,z |
1_555 |
52 |
17 |
16623 |
497.8 |
2.6 |
0.849 |
8 |
2 |
0 |
0.000 |
9 |
|
H |
50 |
18 |
16454 |
◊ |
F |
x,y,z |
1_555 |
49 |
17 |
16565 |
497.3 |
2.5 |
0.852 |
8 |
2 |
0 |
0.000 |
10 |
|
G |
50 |
17 |
16568 |
◊ |
E |
x,y,z |
1_555 |
48 |
17 |
16577 |
497.1 |
2.5 |
0.845 |
8 |
2 |
0 |
0.000 |
11 |
|
K |
50 |
19 |
16533 |
◊ |
I |
x,y,z |
1_555 |
54 |
20 |
16518 |
495.8 |
2.3 |
0.838 |
9 |
2 |
0 |
0.000 |
12 |
|
C |
50 |
17 |
16576 |
◊ |
A |
x,y,z |
1_555 |
48 |
17 |
16590 |
493.0 |
2.6 |
0.850 |
8 |
2 |
0 |
0.000 |
| Average: |
497.0 |
2.4 |
0.846 |
8 |
2 |
0 |
0.000 |
| 3 |
13 |
|
K |
56 |
16 |
16533 |
◊ |
I |
-x+1,y-1/2,-z |
2_645 |
47 |
11 |
16518 |
448.3 |
-5.0 |
0.249 |
3 |
0 |
0 |
0.000 |
14 |
|
A |
43 |
10 |
16590 |
◊ |
C |
-x+1,y-1/2,-z+1 |
2_646 |
57 |
15 |
16576 |
433.0 |
-4.9 |
0.249 |
2 |
0 |
0 |
0.000 |
15 |
|
E |
43 |
10 |
16577 |
◊ |
A |
x,y,z |
1_555 |
52 |
15 |
16590 |
428.6 |
-5.4 |
0.199 |
3 |
0 |
0 |
0.000 |
| Average: |
436.6 |
-5.1 |
0.232 |
3 |
0 |
0 |
0.000 |
| 4 |
16 |
|
K |
41 |
10 |
16533 |
◊ |
H |
-x+2,y-1/2,-z |
2_745 |
52 |
15 |
16454 |
447.7 |
-5.3 |
0.186 |
2 |
0 |
0 |
0.000 |
17 |
|
E |
56 |
16 |
16577 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
38 |
11 |
16576 |
444.2 |
-4.4 |
0.267 |
1 |
0 |
0 |
0.000 |
| Average: |
446.0 |
-4.9 |
0.226 |
2 |
0 |
0 |
0.000 |
| 5 |
18 |
|
I |
47 |
15 |
16518 |
◊ |
H |
x,y,z |
1_555 |
38 |
10 |
16454 |
403.8 |
-3.8 |
0.306 |
2 |
0 |
0 |
0.000 |
| 6 |
19 |
|
L |
43 |
13 |
16686 |
◊ |
G |
-x+2,y-1/2,-z |
2_745 |
39 |
11 |
16568 |
392.0 |
-5.0 |
0.154 |
1 |
0 |
0 |
0.000 |
| 7 |
20 |
|
F |
34 |
12 |
16565 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
40 |
12 |
16573 |
352.1 |
-4.5 |
0.179 |
0 |
0 |
0 |
0.000 |
| 8 |
21 |
|
K |
31 |
9 |
16533 |
◊ |
H |
x,y-1,z |
1_545 |
37 |
8 |
16454 |
290.9 |
-2.5 |
0.352 |
1 |
0 |
0 |
0.000 |
22 |
|
E |
35 |
8 |
16577 |
◊ |
C |
x,y-1,z |
1_545 |
28 |
8 |
16576 |
287.5 |
-1.9 |
0.435 |
0 |
0 |
0 |
0.000 |
23 |
|
L |
34 |
9 |
16686 |
◊ |
A |
-x+1,y-1/2,-z |
2_645 |
20 |
7 |
16590 |
221.0 |
-1.6 |
0.412 |
0 |
0 |
0 |
0.000 |
| Average: |
266.5 |
-2.0 |
0.400 |
0 |
0 |
0 |
0.000 |
| 9 |
24 |
|
J |
31 |
9 |
16700 |
◊ |
H |
x,y,z |
1_555 |
33 |
9 |
16454 |
272.3 |
1.9 |
0.827 |
3 |
3 |
0 |
0.000 |
25 |
|
A |
29 |
8 |
16590 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
21 |
7 |
16573 |
216.8 |
0.5 |
0.703 |
1 |
0 |
0 |
0.000 |
26 |
|
E |
27 |
7 |
16577 |
◊ |
B |
x,y,z |
1_555 |
22 |
7 |
16623 |
214.9 |
0.9 |
0.742 |
1 |
0 |
0 |
0.000 |
27 |
|
L |
21 |
7 |
16686 |
◊ |
I |
-x+1,y-1/2,-z |
2_645 |
29 |
8 |
16518 |
204.3 |
0.6 |
0.721 |
1 |
0 |
0 |
0.000 |
| Average: |
227.1 |
1.0 |
0.748 |
2 |
1 |
0 |
0.000 |
| 10 |
28 |
|
J |
25 |
7 |
16700 |
◊ |
G |
x,y,z |
1_555 |
22 |
7 |
16568 |
197.0 |
-2.4 |
0.277 |
1 |
0 |
0 |
0.000 |
| 11 |
29 |
|
L |
19 |
9 |
16686 |
◊ |
H |
-x+1,y-1/2,-z |
2_645 |
18 |
8 |
16454 |
196.6 |
0.2 |
0.672 |
0 |
0 |
0 |
0.000 |
| 12 |
30 |
|
B |
22 |
8 |
16623 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
18 |
6 |
16573 |
183.7 |
-3.2 |
0.182 |
0 |
0 |
0 |
0.000 |
31 |
|
F |
24 |
8 |
16565 |
◊ |
B |
x,y,z |
1_555 |
21 |
7 |
16623 |
180.7 |
-2.4 |
0.281 |
0 |
0 |
0 |
0.000 |
32 |
|
L |
18 |
6 |
16686 |
◊ |
J |
-x+1,y-1/2,-z |
2_645 |
25 |
8 |
16700 |
173.0 |
-3.3 |
0.195 |
0 |
0 |
0 |
0.000 |
| Average: |
179.1 |
-3.0 |
0.220 |
0 |
0 |
0 |
0.000 |
| 13 |
33 |
|
F |
16 |
5 |
16565 |
◊ |
C |
-x+2,y-1/2,-z+1 |
2_746 |
19 |
7 |
16576 |
112.1 |
-0.0 |
0.615 |
0 |
0 |
0 |
0.000 |
34 |
|
K |
11 |
3 |
16533 |
◊ |
G |
-x+2,y-1/2,-z |
2_745 |
9 |
3 |
16568 |
75.9 |
-0.1 |
0.550 |
0 |
0 |
0 |
0.000 |
| Average: |
94.0 |
-0.1 |
0.582 |
0 |
0 |
0 |
0.000 |
| 14 |
35 |
|
[CL]F:501 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
14 |
6 |
16565 |
58.1 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
36 |
|
[CL]E:501 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
14 |
6 |
16577 |
58.1 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
37 |
|
[CL]I:501 |
1 |
1 |
125 |
f |
I |
x,y,z |
1_555 |
13 |
6 |
16518 |
58.0 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.512 |
38 |
|
[CL]H:501 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
13 |
6 |
16454 |
57.9 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
39 |
|
[CL]J:501 |
1 |
1 |
125 |
f |
J |
x,y,z |
1_555 |
13 |
6 |
16700 |
57.8 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
40 |
|
[CL]C:501 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
14 |
6 |
16576 |
57.7 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.512 |
41 |
|
[CL]G:501 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
13 |
6 |
16568 |
57.6 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
42 |
|
[CL]D:501 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
14 |
6 |
16573 |
57.5 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
43 |
|
[CL]B:501 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
13 |
6 |
16623 |
57.5 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
44 |
|
[CL]A:501 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
16590 |
57.5 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
45 |
|
[CL]K:501 |
1 |
1 |
125 |
f |
K |
x,y,z |
1_555 |
12 |
6 |
16533 |
57.2 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
46 |
|
[CL]L:501 |
1 |
1 |
125 |
f |
L |
x,y,z |
1_555 |
13 |
6 |
16686 |
57.1 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.512 |
| Average: |
57.7 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.512 |
| 15 |
47 |
|
I |
7 |
4 |
16518 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
4 |
1 |
16573 |
57.8 |
1.0 |
0.834 |
0 |
0 |
0 |
0.000 |
| 16 |
48 |
|
E |
2 |
2 |
16577 |
◊ |
D |
-x+1,y-1/2,-z+1 |
2_646 |
6 |
2 |
16573 |
32.8 |
0.3 |
0.586 |
0 |
0 |
0 |
0.000 |
| 17 |
49 |
|
[CL]I:501 |
1 |
1 |
125 |
◊ |
J |
x,y,z |
1_555 |
3 |
1 |
16700 |
29.6 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.131 |
50 |
|
[CL]J:501 |
1 |
1 |
125 |
◊ |
I |
x,y,z |
1_555 |
3 |
1 |
16518 |
29.3 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.131 |
51 |
|
[CL]B:501 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
16590 |
29.2 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.131 |
52 |
|
[CL]L:501 |
1 |
1 |
125 |
◊ |
K |
x,y,z |
1_555 |
3 |
1 |
16533 |
29.1 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.131 |
53 |
|
[CL]D:501 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
3 |
1 |
16576 |
29.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.131 |
54 |
|
[CL]E:501 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
16565 |
28.9 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.131 |
55 |
|
[CL]A:501 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
16623 |
28.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.131 |
56 |
|
[CL]H:501 |
1 |
1 |
125 |
◊ |
G |
x,y,z |
1_555 |
3 |
1 |
16568 |
28.6 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.131 |
57 |
|
[CL]K:501 |
1 |
1 |
125 |
◊ |
L |
x,y,z |
1_555 |
3 |
1 |
16686 |
28.5 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.131 |
58 |
|
[CL]F:501 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
3 |
1 |
16577 |
28.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.131 |
59 |
|
[CL]C:501 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
3 |
1 |
16573 |
28.0 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.131 |
60 |
|
[CL]G:501 |
1 |
1 |
125 |
◊ |
H |
x,y,z |
1_555 |
3 |
1 |
16454 |
28.0 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.131 |
| Average: |
28.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.131 |
| 18 |
61 |
|
G |
2 |
1 |
16568 |
◊ |
D |
-x+2,y-1/2,-z+1 |
2_746 |
1 |
1 |
16573 |
21.5 |
1.1 |
0.917 |
0 |
0 |
0 |
0.000 |
|