## |
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 |
|
A |
55 |
18 |
6601 |
◊ |
A |
-y,-x,-z-1/2 |
8_554 |
55 |
18 |
6601 |
560.1 |
3.1 |
0.681 |
12 |
0 |
0 |
0.000 |
2 |
2 |
|
A |
42 |
10 |
6601 |
◊ |
A |
y,x,-z-1 |
6_554 |
43 |
10 |
6601 |
351.1 |
0.2 |
0.461 |
4 |
0 |
0 |
0.000 |
3 |
3 |
|
A |
32 |
11 |
6601 |
x |
A |
-y-1/2,x+1/2,z-1/4 |
2_454 |
37 |
14 |
6601 |
268.6 |
2.7 |
0.690 |
5 |
0 |
0 |
0.000 |
4 |
4 |
|
A |
17 |
4 |
6601 |
x |
A |
-y-1/2,x+1/2,z+3/4 |
2_455 |
23 |
7 |
6601 |
158.5 |
-0.3 |
0.411 |
1 |
0 |
0 |
0.000 |
5 |
5 |
|
[CL]A:212 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
6601 |
72.7 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.017 |
6 |
6 |
|
[CL]A:213 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
17 |
8 |
6601 |
70.3 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.014 |
7 |
7 |
|
A |
7 |
2 |
6601 |
◊ |
A |
-y,-x,-z+1/2 |
8_555 |
7 |
2 |
6601 |
69.6 |
-1.8 |
0.119 |
0 |
0 |
0 |
0.000 |
8 |
8 |
|
[NA]A:215 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
6601 |
60.8 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.016 |
9 |
9 |
|
[IOD]A:208 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
14 |
8 |
6601 |
60.5 |
0.1 |
0.672 |
0 |
0 |
0 |
0.000 |
10 |
10 |
|
[CL]A:214 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
6601 |
60.1 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.012 |
11 |
11 |
|
[IOD]A:202 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
15 |
5 |
6601 |
58.1 |
0.4 |
0.790 |
0 |
0 |
0 |
0.000 |
12 |
12 |
|
A |
11 |
5 |
6601 |
x |
A |
x,y,z-1 |
1_554 |
5 |
2 |
6601 |
57.4 |
0.6 |
0.559 |
0 |
0 |
0 |
0.000 |
13 |
13 |
|
A |
9 |
4 |
6601 |
f |
[CL]A:211 |
-y-1/2,x+1/2,z-1/4 |
2_454 |
1 |
1 |
125 |
54.5 |
-7.7 |
0.000 |
0 |
0 |
0 |
0.011 |
14 |
14 |
|
[IOD]A:203 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
9 |
2 |
6601 |
45.1 |
0.9 |
0.947 |
0 |
0 |
0 |
0.000 |
15 |
15 |
|
[IOD]A:204 |
1 |
1 |
144 |
x |
A |
x,y,z |
1_555 |
10 |
4 |
6601 |
44.0 |
-0.4 |
0.476 |
0 |
0 |
0 |
0.000 |
16 |
|
[IOD]A:207 |
1 |
1 |
144 |
x |
A |
x,y,z |
1_555 |
4 |
1 |
6601 |
24.0 |
-0.1 |
0.635 |
0 |
0 |
0 |
0.000 |
Average: |
34.0 |
-0.2 |
0.556 |
0 |
0 |
0 |
0.000 |
16 |
17 |
|
[CL]A:211 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
11 |
5 |
6601 |
40.9 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.000 |
17 |
18 |
|
[IOD]A:207 |
1 |
1 |
144 |
x |
A |
y,x,-z-1 |
6_554 |
11 |
5 |
6601 |
38.1 |
-0.0 |
0.623 |
0 |
0 |
0 |
0.000 |
19 |
|
[IOD]A:206 |
1 |
1 |
144 |
x |
A |
x,y,z |
1_555 |
6 |
5 |
6601 |
22.7 |
0.6 |
0.873 |
0 |
0 |
0 |
0.000 |
Average: |
30.4 |
0.3 |
0.748 |
0 |
0 |
0 |
0.000 |
18 |
20 |
|
[IOD]A:205 |
1 |
1 |
144 |
◊ |
A |
x,y,z |
1_555 |
10 |
5 |
6601 |
37.4 |
-0.0 |
0.619 |
0 |
0 |
0 |
0.000 |
19 |
21 |
|
[IOD]A:201 |
1 |
1 |
144 |
f |
A |
x,y,z |
1_555 |
9 |
5 |
6601 |
36.7 |
1.1 |
0.959 |
0 |
0 |
0 |
0.000 |
20 |
22 |
|
[PT]A:209 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
5 |
6601 |
34.0 |
-8.2 |
0.000 |
0 |
0 |
0 |
0.012 |
21 |
23 |
|
[PT]A:210 |
1 |
1 |
125 |
f |
[IOD]A:206 |
x,y,z |
1_555 |
1 |
1 |
144 |
28.3 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.016 |
22 |
24 |
|
[PT]A:209 |
1 |
1 |
125 |
f |
[IOD]A:201 |
x,y,z |
1_555 |
1 |
1 |
144 |
26.8 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.007 |
23 |
25 |
|
[PT]A:210 |
1 |
1 |
125 |
f |
[IOD]A:204 |
x,y,z |
1_555 |
1 |
1 |
144 |
26.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.015 |
24 |
26 |
|
[PT]A:209 |
1 |
1 |
125 |
f |
[IOD]A:203 |
x,y,z |
1_555 |
1 |
1 |
144 |
25.6 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.006 |
25 |
27 |
|
[IOD]A:201 |
1 |
1 |
144 |
◊ |
A |
y,x,-z-1 |
6_554 |
2 |
1 |
6601 |
24.4 |
0.5 |
0.939 |
0 |
0 |
0 |
0.000 |
28 |
|
[IOD]A:202 |
1 |
1 |
144 |
◊ |
A |
y,x,-z-1 |
6_554 |
1 |
1 |
6601 |
4.5 |
0.2 |
0.924 |
0 |
0 |
0 |
0.000 |
Average: |
14.5 |
0.3 |
0.932 |
0 |
0 |
0 |
0.000 |
26 |
29 |
|
[IOD]A:203 |
1 |
1 |
144 |
f |
[IOD]A:201 |
x,y,z |
1_555 |
1 |
1 |
144 |
24.4 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
[PT]A:209 |
1 |
1 |
125 |
f |
[IOD]A:202 |
x,y,z |
1_555 |
1 |
1 |
144 |
23.8 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.006 |
28 |
31 |
|
[IOD]A:202 |
1 |
1 |
144 |
f |
[IOD]A:201 |
x,y,z |
1_555 |
1 |
1 |
144 |
23.7 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
29 |
32 |
|
[IOD]A:208 |
1 |
1 |
144 |
f |
[IOD]A:205 |
x,y,z |
1_555 |
1 |
1 |
144 |
23.7 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
30 |
33 |
|
[IOD]A:203 |
1 |
1 |
144 |
◊ |
A |
y,x,-z-1 |
6_554 |
1 |
1 |
6601 |
22.9 |
0.4 |
0.966 |
0 |
0 |
0 |
0.000 |
31 |
34 |
|
[IOD]A:206 |
1 |
1 |
144 |
fx |
[IOD]A:205 |
x,y,z |
1_555 |
1 |
1 |
144 |
22.9 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
32 |
35 |
|
[PT]A:210 |
1 |
1 |
125 |
fx |
[IOD]A:207 |
x,y,z |
1_555 |
1 |
1 |
144 |
21.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.032 |
33 |
36 |
|
[IOD]A:207 |
1 |
1 |
144 |
fx |
[IOD]A:206 |
x,y,z |
1_555 |
1 |
1 |
144 |
21.7 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
34 |
37 |
|
[PT]A:210 |
1 |
1 |
125 |
fx |
[IOD]A:205 |
x,y,z |
1_555 |
1 |
1 |
144 |
21.5 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.032 |
35 |
38 |
|
[PT]A:210 |
1 |
1 |
125 |
x |
A |
x,y,z |
1_555 |
7 |
3 |
6601 |
21.1 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.000 |
36 |
39 |
|
[IOD]A:207 |
1 |
1 |
144 |
fx |
[IOD]A:204 |
x,y,z |
1_555 |
1 |
1 |
144 |
21.1 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
37 |
40 |
|
[IOD]A:205 |
1 |
1 |
144 |
fx |
[IOD]A:204 |
x,y,z |
1_555 |
1 |
1 |
144 |
19.9 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
38 |
41 |
|
[IOD]A:208 |
1 |
1 |
144 |
fx |
[IOD]A:206 |
x,y,z |
1_555 |
1 |
1 |
144 |
18.1 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
39 |
42 |
|
[IOD]A:207 |
1 |
1 |
144 |
fx |
[IOD]A:205 |
x,y,z |
1_555 |
1 |
1 |
144 |
16.9 |
0.1 |
1.000 |
0 |
0 |
0 |
0.000 |
40 |
43 |
|
[PT]A:209 |
1 |
1 |
125 |
◊ |
A |
y,x,-z-1 |
6_554 |
1 |
1 |
6601 |
15.9 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
41 |
44 |
|
[NA]A:215 |
1 |
1 |
125 |
f |
[CL]A:213 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.6 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.004 |
42 |
45 |
|
[IOD]A:206 |
1 |
1 |
144 |
f |
[IOD]A:204 |
x,y,z |
1_555 |
1 |
1 |
144 |
12.4 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
43 |
46 |
|
[IOD]A:203 |
1 |
1 |
144 |
f |
[IOD]A:202 |
x,y,z |
1_555 |
1 |
1 |
144 |
11.2 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
44 |
47 |
|
[PT]A:210 |
1 |
1 |
125 |
fx |
[IOD]A:208 |
x,y,z |
1_555 |
1 |
1 |
144 |
8.4 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.010 |
45 |
48 |
|
[IOD]A:207 |
1 |
1 |
144 |
f |
[IOD]A:207 |
y,x,-z-1 |
6_554 |
1 |
1 |
144 |
8.3 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
46 |
49 |
|
[IOD]A:205 |
1 |
1 |
144 |
f |
[IOD]A:205 |
y,x,-z-1 |
6_554 |
1 |
1 |
144 |
7.4 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
47 |
50 |
|
A |
1 |
1 |
6601 |
x |
A |
-x-1/2,y-1/2,-z-1/4 |
7_444 |
2 |
1 |
6601 |
5.1 |
0.2 |
0.744 |
0 |
0 |
0 |
0.000 |
48 |
51 |
|
[IOD]A:208 |
1 |
1 |
144 |
fx |
[IOD]A:207 |
x,y,z |
1_555 |
1 |
1 |
144 |
2.6 |
0.0 |
1.000 |
0 |
0 |
0 |
0.000 |
49 |
52 |
|
[IOD]A:205 |
1 |
1 |
144 |
◊ |
A |
y,x,-z-1 |
6_554 |
2 |
2 |
6601 |
0.9 |
-0.0 |
0.735 |
0 |
0 |
0 |
0.000 |
|