| ## |
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 |
|
F |
340 |
95 |
16353 |
◊ |
E |
x,y,z |
1_555 |
335 |
96 |
16410 |
3399.9 |
-25.1 |
0.074 |
52 |
16 |
0 |
0.675 |
2 |
|
B |
324 |
92 |
16273 |
◊ |
A |
x,y,z |
1_555 |
337 |
95 |
16280 |
3254.1 |
-23.1 |
0.102 |
54 |
16 |
0 |
0.675 |
3 |
|
H |
324 |
92 |
16066 |
◊ |
G |
x,y,z |
1_555 |
312 |
94 |
16489 |
3194.2 |
-20.7 |
0.121 |
53 |
16 |
0 |
0.675 |
| Average: |
3282.7 |
-23.0 |
0.099 |
53 |
16 |
0 |
0.675 |
| 2 |
4 |
|
G |
78 |
20 |
16489 |
◊ |
F |
x,y,z |
1_555 |
79 |
20 |
16353 |
748.3 |
-0.8 |
0.582 |
12 |
0 |
0 |
0.087 |
5 |
|
H |
80 |
18 |
16066 |
◊ |
E |
x,y,z |
1_555 |
76 |
19 |
16410 |
731.3 |
-1.2 |
0.552 |
12 |
0 |
0 |
0.087 |
6 |
|
B |
79 |
19 |
16273 |
◊ |
B |
-x-1,y,-z |
2_455 |
78 |
19 |
16273 |
721.9 |
-1.8 |
0.536 |
12 |
0 |
0 |
0.087 |
7 |
|
A |
75 |
18 |
16280 |
◊ |
A |
-x-1,y,-z |
2_455 |
75 |
18 |
16280 |
714.7 |
-2.0 |
0.498 |
12 |
0 |
0 |
0.087 |
| Average: |
729.0 |
-1.4 |
0.542 |
12 |
0 |
0 |
0.087 |
| 3 |
8 |
|
E |
77 |
24 |
16410 |
◊ |
A |
x,y,z |
1_555 |
84 |
28 |
16280 |
697.2 |
-2.5 |
0.498 |
8 |
0 |
0 |
0.000 |
| 4 |
9 |
|
F |
51 |
14 |
16353 |
◊ |
B |
x,y-1,z |
1_545 |
50 |
18 |
16273 |
476.7 |
3.5 |
0.868 |
7 |
6 |
0 |
0.000 |
| 5 |
10 |
|
A |
53 |
14 |
16280 |
◊ |
G |
x-1,y,z |
1_455 |
56 |
16 |
16489 |
461.8 |
-0.1 |
0.616 |
8 |
0 |
0 |
0.000 |
| 6 |
11 |
|
E |
31 |
9 |
16410 |
◊ |
H |
x-1,y,z |
1_455 |
37 |
10 |
16066 |
294.4 |
0.2 |
0.645 |
2 |
0 |
0 |
0.000 |
| 7 |
12 |
|
E |
26 |
9 |
16410 |
◊ |
A |
-x-1/2,y-1/2,-z-1/2 |
4_444 |
28 |
8 |
16280 |
206.1 |
0.6 |
0.686 |
2 |
0 |
0 |
0.000 |
| 8 |
13 |
|
H |
26 |
8 |
16066 |
◊ |
B |
-x-1/2,y-1/2,-z-1/2 |
4_444 |
17 |
6 |
16273 |
191.1 |
0.6 |
0.639 |
1 |
0 |
0 |
0.000 |
| 9 |
14 |
|
E |
23 |
5 |
16410 |
x |
E |
-x-1/2,y-1/2,-z-1/2 |
4_444 |
27 |
8 |
16410 |
175.2 |
-0.8 |
0.488 |
1 |
0 |
0 |
0.000 |
| 10 |
15 |
|
F |
13 |
4 |
16353 |
◊ |
G |
x-1,y,z |
1_455 |
10 |
3 |
16489 |
98.2 |
0.5 |
0.597 |
3 |
0 |
0 |
0.000 |
| 11 |
16 |
|
G |
12 |
6 |
16489 |
◊ |
E |
x,y,z |
1_555 |
12 |
6 |
16410 |
95.4 |
-1.8 |
0.187 |
0 |
0 |
0 |
0.023 |
17 |
|
H |
11 |
6 |
16066 |
◊ |
F |
x,y,z |
1_555 |
10 |
6 |
16353 |
95.3 |
-1.9 |
0.143 |
0 |
0 |
0 |
0.023 |
18 |
|
B |
10 |
6 |
16273 |
◊ |
A |
-x-1,y,-z |
2_455 |
10 |
6 |
16280 |
91.0 |
-1.9 |
0.127 |
0 |
0 |
0 |
0.023 |
| Average: |
93.9 |
-1.9 |
0.152 |
0 |
0 |
0 |
0.023 |
| 12 |
19 |
|
[CL]F:403 |
1 |
1 |
125 |
f |
F |
x,y,z |
1_555 |
9 |
6 |
16353 |
67.7 |
-10.6 |
0.000 |
0 |
0 |
0 |
0.293 |
20 |
|
[CL]G:403 |
1 |
1 |
125 |
f |
G |
x,y,z |
1_555 |
9 |
6 |
16489 |
67.2 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.293 |
21 |
|
[CL]E:403 |
1 |
1 |
125 |
f |
E |
x,y,z |
1_555 |
9 |
6 |
16410 |
67.1 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.293 |
22 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
9 |
6 |
16280 |
66.9 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.293 |
23 |
|
[CL]B:403 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
9 |
6 |
16273 |
66.8 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.293 |
24 |
|
[CL]H:403 |
1 |
1 |
125 |
f |
H |
x,y,z |
1_555 |
9 |
6 |
16066 |
66.7 |
-10.3 |
0.000 |
0 |
0 |
0 |
0.293 |
| Average: |
67.1 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.293 |
| 13 |
25 |
|
H |
10 |
3 |
16066 |
x |
H |
-x+1/2,y-1/2,-z-1/2 |
4_544 |
9 |
4 |
16066 |
64.1 |
0.8 |
0.703 |
0 |
0 |
0 |
0.000 |
| 14 |
26 |
|
E |
7 |
3 |
16410 |
◊ |
B |
-x-1/2,y-1/2,-z-1/2 |
4_444 |
5 |
2 |
16273 |
45.3 |
0.1 |
0.617 |
0 |
0 |
0 |
0.000 |
| 15 |
27 |
|
H |
6 |
3 |
16066 |
◊ |
A |
-x-1/2,y-1/2,-z-1/2 |
4_444 |
6 |
5 |
16280 |
44.6 |
1.2 |
0.856 |
0 |
1 |
0 |
0.000 |
| 16 |
28 |
|
F |
5 |
3 |
16353 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
16280 |
26.5 |
0.3 |
0.703 |
0 |
0 |
0 |
0.000 |
| 17 |
29 |
|
[CL]A:403 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
4 |
2 |
16273 |
21.6 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.050 |
30 |
|
[CL]H:403 |
1 |
1 |
125 |
◊ |
G |
x,y,z |
1_555 |
3 |
1 |
16489 |
21.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.050 |
31 |
|
[CL]B:403 |
1 |
1 |
125 |
◊ |
A |
x,y,z |
1_555 |
3 |
1 |
16280 |
20.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.050 |
32 |
|
[CL]G:403 |
1 |
1 |
125 |
◊ |
H |
x,y,z |
1_555 |
2 |
1 |
16066 |
20.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.050 |
33 |
|
[CL]E:403 |
1 |
1 |
125 |
◊ |
F |
x,y,z |
1_555 |
3 |
1 |
16353 |
20.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.050 |
34 |
|
[CL]F:403 |
1 |
1 |
125 |
◊ |
E |
x,y,z |
1_555 |
2 |
1 |
16410 |
20.4 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.050 |
| Average: |
20.8 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.050 |
| 18 |
35 |
|
B |
3 |
2 |
16273 |
◊ |
H |
x-1,y+1,z |
1_465 |
2 |
1 |
16066 |
5.2 |
-0.1 |
0.542 |
0 |
0 |
0 |
0.000 |
| 19 |
36 |
|
B |
1 |
1 |
16273 |
◊ |
G |
x-1,y+1,z |
1_465 |
1 |
1 |
16489 |
0.9 |
-0.0 |
0.597 |
0 |
0 |
0 |
0.000 |
|