## |
Structure 1 |
× |
Structure 2 |
interface area, Å2 |
ΔiG kcal/mol |
ΔiG P-value |
NHB |
NSB |
NDS |
CSS |
NN |
«» |
Range |
iNat |
iNres |
Surface Å2 |
Range |
Symmetry op-n |
Sym.ID |
iNat |
iNres |
Surface Å2 |
1 |
|
T |
62 |
13 |
3547 |
◊ |
S |
x,y,z |
1_555 |
48 |
13 |
3075 |
567.6 |
-13.3 |
0.427 |
40 |
0 |
0 |
0.997 |
2 |
|
T |
59 |
9 |
3547 |
◊ |
P |
x,y,z |
1_555 |
72 |
26 |
17954 |
544.9 |
-11.4 |
0.330 |
18 |
0 |
0 |
0.533 |
3 |
|
S |
60 |
8 |
3075 |
◊ |
P |
x,y,z |
1_555 |
65 |
22 |
17954 |
518.5 |
-7.5 |
0.469 |
11 |
0 |
0 |
0.167 |
4 |
|
P |
32 |
7 |
17954 |
◊ |
T |
-x+1/2,y-1/2,-z+2 |
3_547 |
38 |
4 |
3547 |
326.2 |
0.2 |
0.392 |
3 |
0 |
0 |
0.000 |
5 |
|
[DDS]P:401 |
24 |
1 |
585 |
f |
P |
x,y,z |
1_555 |
45 |
19 |
17954 |
304.8 |
0.5 |
0.459 |
8 |
0 |
0 |
0.084 |
6 |
|
P |
28 |
9 |
17954 |
x |
P |
x,y,z-1 |
1_554 |
35 |
9 |
17954 |
288.6 |
-4.1 |
0.166 |
2 |
0 |
0 |
0.000 |
7 |
|
P |
31 |
9 |
17954 |
◊ |
S |
-x+1/2,y-1/2,-z+2 |
3_547 |
26 |
3 |
3075 |
277.2 |
-1.5 |
0.595 |
1 |
0 |
0 |
0.000 |
8 |
|
P |
31 |
8 |
17954 |
x |
P |
x-1/2,-y+1/2,-z+2 |
4_457 |
33 |
10 |
17954 |
273.8 |
0.1 |
0.569 |
4 |
5 |
0 |
0.000 |
9 |
|
P |
22 |
5 |
17954 |
x |
P |
-x+1/2,y-1/2,-z+1 |
3_546 |
27 |
9 |
17954 |
215.7 |
0.4 |
0.565 |
3 |
0 |
0 |
0.000 |
10 |
|
P |
23 |
6 |
17954 |
◊ |
P |
-x+1,-y,z |
2_655 |
23 |
6 |
17954 |
193.5 |
4.0 |
0.891 |
0 |
2 |
0 |
0.000 |
11 |
|
[EDO]P:504 |
4 |
1 |
187 |
◊ |
P |
x,y,z |
1_555 |
15 |
7 |
17954 |
102.8 |
2.5 |
0.395 |
2 |
0 |
0 |
0.000 |
12 |
|
[EDO]P:506 |
4 |
1 |
183 |
f |
P |
x,y,z |
1_555 |
13 |
6 |
17954 |
96.7 |
3.4 |
0.484 |
1 |
0 |
0 |
0.000 |
13 |
|
[EDO]P:502 |
4 |
1 |
186 |
f |
P |
x,y,z |
1_555 |
9 |
4 |
17954 |
95.3 |
3.0 |
0.317 |
1 |
0 |
0 |
0.000 |
14 |
|
[EDO]P:501 |
4 |
1 |
187 |
◊ |
P |
x,y,z |
1_555 |
21 |
6 |
17954 |
92.9 |
2.4 |
0.256 |
3 |
0 |
0 |
0.000 |
15 |
|
[DDS]P:401 |
14 |
1 |
585 |
◊ |
T |
x,y,z |
1_555 |
12 |
1 |
3547 |
91.8 |
1.8 |
0.593 |
0 |
0 |
0 |
0.000 |
16 |
|
[DDS]P:401 |
11 |
1 |
585 |
◊ |
S |
x,y,z |
1_555 |
13 |
1 |
3075 |
83.2 |
2.4 |
0.688 |
0 |
0 |
0 |
0.000 |
17 |
|
[EDO]P:503 |
4 |
1 |
187 |
◊ |
P |
x,y,z |
1_555 |
15 |
4 |
17954 |
79.0 |
1.3 |
0.207 |
2 |
0 |
0 |
0.000 |
18 |
|
[EDO]P:502 |
4 |
1 |
186 |
◊ |
S |
x,y,z |
1_555 |
10 |
2 |
3075 |
52.0 |
2.6 |
0.903 |
0 |
0 |
0 |
0.000 |
19 |
|
[EDO]P:505 |
4 |
1 |
185 |
f |
P |
x,y,z |
1_555 |
8 |
1 |
17954 |
42.9 |
0.4 |
0.640 |
1 |
0 |
0 |
0.000 |
20 |
|
[CA]P:407 |
1 |
1 |
85 |
f |
P |
x,y,z |
1_555 |
8 |
6 |
17954 |
39.7 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.217 |
21 |
|
P |
2 |
1 |
17954 |
x |
P |
-x+1/2,y-1/2,-z+2 |
3_547 |
5 |
2 |
17954 |
35.2 |
1.3 |
0.803 |
1 |
2 |
0 |
0.000 |
22 |
|
[CA]P:406 |
1 |
1 |
85 |
f |
P |
x,y,z |
1_555 |
9 |
8 |
17954 |
33.6 |
-7.4 |
0.000 |
0 |
0 |
0 |
0.204 |
23 |
|
[DDS]P:401 |
5 |
1 |
585 |
f |
[CA]P:406 |
x,y,z |
1_555 |
1 |
1 |
85 |
28.4 |
-5.5 |
0.000 |
0 |
0 |
0 |
0.151 |
24 |
|
[EDO]P:501 |
3 |
1 |
187 |
f |
S |
x,y,z |
1_555 |
2 |
1 |
3075 |
19.2 |
-0.3 |
0.519 |
0 |
0 |
0 |
0.100 |
25 |
|
P |
1 |
1 |
17954 |
◊ |
S |
x,y,z-1 |
1_554 |
1 |
1 |
3075 |
18.7 |
-0.2 |
0.390 |
1 |
0 |
0 |
0.000 |
26 |
|
P |
2 |
2 |
17954 |
x |
P |
x-1/2,-y+1/2,-z+1 |
4_456 |
2 |
1 |
17954 |
17.7 |
1.1 |
0.901 |
0 |
0 |
0 |
0.000 |
27 |
|
[EDO]P:503 |
3 |
1 |
187 |
◊ |
S |
x,y,z |
1_555 |
4 |
1 |
3075 |
17.4 |
0.6 |
0.721 |
0 |
0 |
0 |
0.000 |
28 |
|
[EDO]P:504 |
2 |
1 |
187 |
f |
T |
x,y,z |
1_555 |
1 |
1 |
3547 |
14.6 |
0.3 |
0.653 |
0 |
0 |
0 |
0.000 |
29 |
|
P |
1 |
1 |
17954 |
◊ |
T |
x-1/2,-y+1/2,-z+2 |
4_457 |
3 |
1 |
3547 |
14.2 |
-0.5 |
0.573 |
0 |
0 |
0 |
0.000 |
30 |
|
[CA]P:407 |
1 |
1 |
85 |
◊ |
T |
x,y,z |
1_555 |
3 |
1 |
3547 |
12.1 |
-2.4 |
0.000 |
0 |
0 |
0 |
0.066 |
31 |
|
S |
1 |
1 |
3075 |
◊ |
P |
x-1/2,-y+1/2,-z+2 |
4_457 |
1 |
1 |
17954 |
3.8 |
-0.2 |
0.368 |
0 |
0 |
0 |
0.000 |
32 |
|
P |
1 |
1 |
17954 |
f |
[EDO]P:503 |
x-1/2,-y+1/2,-z+2 |
4_457 |
1 |
1 |
187 |
2.9 |
0.1 |
0.863 |
0 |
0 |
0 |
0.000 |
33 |
|
[EDO]P:502 |
1 |
1 |
186 |
f |
[DDS]P:401 |
x,y,z |
1_555 |
1 |
1 |
585 |
0.7 |
0.0 |
0.616 |
0 |
0 |
0 |
0.000 |
|