## |
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 |
99 |
25 |
15162 |
◊ |
A |
x,-y+1/2,-z+1/4 |
6_555 |
99 |
25 |
15162 |
752.0 |
-3.6 |
0.593 |
8 |
6 |
0 |
0.018 |
2 |
2 |
|
A |
50 |
16 |
15162 |
◊ |
A |
y,x,-z |
15_444 |
51 |
16 |
15162 |
485.9 |
-3.0 |
0.471 |
10 |
0 |
0 |
0.017 |
3 |
3 |
|
A |
47 |
14 |
15162 |
◊ |
A |
-x+1,-y+1,z |
10_554 |
47 |
14 |
15162 |
409.9 |
-2.6 |
0.517 |
3 |
4 |
0 |
0.010 |
4 |
4 |
|
[Y41]A:501 |
23 |
1 |
510 |
f |
A |
x,y,z |
1_555 |
52 |
16 |
15162 |
362.3 |
0.8 |
0.462 |
2 |
0 |
0 |
0.000 |
5 |
5 |
|
A |
24 |
7 |
15162 |
◊ |
A |
-y+1,-x+1,-z |
8_665 |
25 |
8 |
15162 |
238.0 |
-1.6 |
0.467 |
4 |
0 |
0 |
0.007 |
6 |
6 |
|
[ACT]A:511 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
15162 |
71.7 |
0.3 |
0.756 |
0 |
0 |
0 |
0.000 |
7 |
7 |
|
[CL]A:510 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
15162 |
69.2 |
-9.7 |
0.000 |
0 |
0 |
0 |
0.045 |
8 |
8 |
|
[UNX]A:516 |
1 |
1 |
129 |
f |
A |
x,-y+1/2,-z+1/4 |
6_555 |
10 |
5 |
15162 |
58.6 |
-4.3 |
0.000 |
0 |
0 |
0 |
0.020 |
9 |
9 |
|
[CL]A:507 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
1 |
1 |
15162 |
57.0 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.053 |
10 |
10 |
|
[ZN]A:504 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
10 |
5 |
15162 |
50.9 |
-33.4 |
0.000 |
0 |
0 |
0 |
0.154 |
11 |
11 |
|
[ZN]A:503 |
1 |
1 |
98 |
cf |
A |
x,y,z |
1_555 |
4 |
4 |
15162 |
45.5 |
-34.7 |
0.000 |
0 |
0 |
0 |
0.160 |
12 |
12 |
|
[UNX]A:514 |
1 |
1 |
129 |
◊ |
A |
x,-y+1/2,-z+1/4 |
6_555 |
9 |
6 |
15162 |
45.4 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.013 |
13 |
13 |
|
[ZN]A:506 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
4 |
15162 |
44.6 |
-27.0 |
0.000 |
0 |
0 |
0 |
0.125 |
14 |
14 |
|
[CL]A:508 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
15162 |
43.2 |
-5.3 |
0.000 |
0 |
0 |
0 |
0.024 |
15 |
15 |
|
[UNX]A:513 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
4 |
1 |
15162 |
43.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.023 |
16 |
|
[UNX]A:512 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
4 |
2 |
15162 |
34.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.023 |
17 |
|
[UNX]A:515 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
3 |
2 |
15162 |
16.6 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.023 |
Average: |
31.4 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.023 |
16 |
18 |
|
[CL]A:509 |
1 |
1 |
125 |
◊ |
A |
-x+1,-y+1,z |
10_554 |
8 |
4 |
15162 |
38.8 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.019 |
17 |
19 |
|
[UNX]A:515 |
1 |
1 |
129 |
◊ |
A |
x,-y+1/2,-z+1/4 |
6_555 |
8 |
4 |
15162 |
38.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.012 |
20 |
|
[UNX]A:512 |
1 |
1 |
129 |
◊ |
A |
x,-y+1/2,-z+1/4 |
6_555 |
5 |
2 |
15162 |
17.0 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.012 |
Average: |
27.8 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.012 |
18 |
21 |
|
[ACT]A:511 |
3 |
1 |
184 |
◊ |
A |
-x+1,-y+1,z |
10_554 |
6 |
2 |
15162 |
35.1 |
0.2 |
0.738 |
0 |
0 |
0 |
0.000 |
19 |
22 |
|
[CL]A:509 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
15162 |
31.7 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.014 |
20 |
23 |
|
[UNX]A:513 |
1 |
1 |
129 |
f |
[UNX]A:512 |
x,y,z |
1_555 |
1 |
1 |
129 |
31.5 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.015 |
21 |
24 |
|
[CL]A:510 |
1 |
1 |
125 |
f |
[ZN]A:506 |
x,y,z |
1_555 |
1 |
1 |
98 |
29.5 |
-15.0 |
0.000 |
0 |
0 |
0 |
0.069 |
22 |
25 |
|
[UNX]A:516 |
1 |
1 |
129 |
◊ |
[UNX]A:514 |
x,y,z |
1_555 |
1 |
1 |
129 |
29.2 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.013 |
23 |
26 |
|
[UNX]A:515 |
1 |
1 |
129 |
f |
[UNX]A:512 |
x,y,z |
1_555 |
1 |
1 |
129 |
28.7 |
-2.9 |
0.000 |
0 |
0 |
0 |
0.013 |
24 |
27 |
|
[ZN]A:505 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
10 |
5 |
15162 |
27.0 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.055 |
25 |
28 |
|
[UNX]A:515 |
1 |
1 |
129 |
f |
[UNX]A:514 |
x,y,z |
1_555 |
1 |
1 |
129 |
26.0 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.012 |
26 |
29 |
|
A |
2 |
1 |
15162 |
x |
A |
-x+1,y-1/2,-z+1/4 |
13_544 |
2 |
1 |
15162 |
24.8 |
1.4 |
0.942 |
0 |
0 |
0 |
0.000 |
27 |
30 |
|
[ZN]A:505 |
1 |
1 |
98 |
◊ |
A |
-x+1,-y+1,z |
10_554 |
7 |
3 |
15162 |
24.3 |
-9.9 |
0.000 |
0 |
0 |
0 |
0.044 |
28 |
31 |
|
[CL]A:508 |
1 |
1 |
125 |
◊ |
A |
-x+1,-y+1,z |
10_554 |
5 |
2 |
15162 |
23.0 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.009 |
29 |
32 |
|
[ACT]A:511 |
3 |
1 |
184 |
f |
[CL]A:508 |
x,y,z |
1_555 |
1 |
1 |
125 |
20.0 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.008 |
30 |
33 |
|
[ACT]A:511 |
2 |
1 |
184 |
f |
[CL]A:509 |
x,y,z |
1_555 |
1 |
1 |
125 |
19.1 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.008 |
31 |
34 |
|
[CL]A:508 |
1 |
1 |
125 |
f |
[ZN]A:505 |
x,y,z |
1_555 |
1 |
1 |
98 |
18.1 |
-9.2 |
0.000 |
0 |
0 |
0 |
0.043 |
32 |
35 |
|
[CL]A:509 |
1 |
1 |
125 |
f |
[ZN]A:505 |
x,y,z |
1_555 |
1 |
1 |
98 |
18.0 |
-9.0 |
0.000 |
0 |
0 |
0 |
0.042 |
33 |
36 |
|
[UNX]A:514 |
1 |
1 |
129 |
f |
[UNX]A:512 |
x,y,z |
1_555 |
1 |
1 |
129 |
16.6 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.008 |
34 |
37 |
|
[UNX]A:516 |
1 |
1 |
129 |
◊ |
[UNX]A:515 |
x,y,z |
1_555 |
1 |
1 |
129 |
14.0 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.006 |
35 |
38 |
|
[CL]A:509 |
1 |
1 |
125 |
f |
[CL]A:508 |
x,y,z |
1_555 |
1 |
1 |
125 |
13.9 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.013 |
36 |
39 |
|
[UNX]A:515 |
1 |
1 |
129 |
f |
[UNX]A:513 |
x,y,z |
1_555 |
1 |
1 |
129 |
12.5 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.006 |
37 |
40 |
|
[CL]A:507 |
1 |
1 |
125 |
f |
[ZN]A:503 |
x,y,z |
1_555 |
1 |
1 |
98 |
11.0 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.026 |
38 |
41 |
|
[UNX]A:514 |
1 |
1 |
129 |
f |
A |
x,y,z |
1_555 |
2 |
1 |
15162 |
10.8 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.003 |
39 |
42 |
|
[ZN]A:504 |
1 |
1 |
98 |
◊ |
A |
y,x,-z |
15_444 |
4 |
2 |
15162 |
9.7 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.019 |
40 |
43 |
|
[ZN]A:502 |
1 |
1 |
98 |
f |
A |
-y+1,-x+1,-z |
8_665 |
3 |
1 |
15162 |
8.3 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.017 |
41 |
44 |
|
[ACT]A:511 |
3 |
1 |
184 |
f |
[ZN]A:505 |
x,y,z |
1_555 |
1 |
1 |
98 |
7.8 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.010 |
42 |
45 |
|
[UNX]A:516 |
1 |
1 |
129 |
◊ |
[UNX]A:512 |
x,y,z |
1_555 |
1 |
1 |
129 |
1.3 |
-0.1 |
0.000 |
0 |
0 |
0 |
0.000 |
|