## |
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 |
|
B |
224 |
62 |
17974 |
◊ |
A |
x,y,z |
1_555 |
226 |
62 |
17968 |
2020.1 |
-30.5 |
0.046 |
10 |
0 |
0 |
0.531 |
2 |
2 |
|
B |
142 |
40 |
17974 |
◊ |
A |
-x,-x+y,-z+2/3 |
6_555 |
145 |
40 |
17968 |
1227.6 |
-12.6 |
0.398 |
9 |
2 |
0 |
0.353 |
3 |
3 |
|
B |
81 |
27 |
17974 |
◊ |
B |
-x,-x+y,-z+2/3 |
6_555 |
81 |
27 |
17974 |
741.5 |
-11.9 |
0.112 |
6 |
0 |
0 |
0.152 |
4 |
|
A |
80 |
27 |
17968 |
◊ |
A |
-x,-x+y,-z+2/3 |
6_555 |
80 |
27 |
17968 |
741.2 |
-12.0 |
0.101 |
6 |
0 |
0 |
0.152 |
Average: |
741.3 |
-11.9 |
0.106 |
6 |
0 |
0 |
0.152 |
4 |
5 |
|
[LNC]A:332 |
49 |
1 |
961 |
f |
A |
x,y,z |
1_555 |
88 |
34 |
17968 |
686.8 |
-8.4 |
0.391 |
12 |
0 |
0 |
0.574 |
6 |
|
[LNC]B:332 |
50 |
1 |
961 |
f |
B |
x,y,z |
1_555 |
89 |
34 |
17974 |
686.3 |
-8.5 |
0.393 |
12 |
0 |
0 |
0.574 |
Average: |
686.5 |
-8.4 |
0.392 |
12 |
0 |
0 |
0.574 |
5 |
7 |
|
[CIT]B:333 |
12 |
1 |
306 |
cf |
B |
x,y,z |
1_555 |
24 |
7 |
17974 |
152.9 |
-0.5 |
0.360 |
2 |
0 |
0 |
0.058 |
8 |
|
[CIT]A:333 |
12 |
1 |
305 |
cf |
A |
x,y,z |
1_555 |
24 |
7 |
17968 |
152.3 |
-0.5 |
0.384 |
2 |
0 |
0 |
0.058 |
Average: |
152.6 |
-0.5 |
0.372 |
2 |
0 |
0 |
0.058 |
6 |
9 |
|
B |
17 |
7 |
17974 |
x |
B |
-y+1,x-y+1,z-1/3 |
2_664 |
13 |
6 |
17974 |
127.0 |
-0.7 |
0.369 |
0 |
0 |
0 |
0.000 |
7 |
10 |
|
[CIT]B:333 |
6 |
1 |
306 |
◊ |
B |
-x,-x+y,-z+2/3 |
6_555 |
14 |
7 |
17974 |
83.3 |
0.7 |
0.464 |
0 |
0 |
0 |
0.000 |
11 |
|
[CIT]A:333 |
7 |
1 |
305 |
◊ |
A |
-x,-x+y,-z+2/3 |
6_555 |
15 |
7 |
17968 |
83.2 |
0.7 |
0.485 |
0 |
0 |
0 |
0.000 |
Average: |
83.2 |
0.7 |
0.474 |
0 |
0 |
0 |
0.000 |
8 |
12 |
|
[ACE]A:0 |
3 |
1 |
173 |
cf |
A |
x,y,z |
1_555 |
6 |
4 |
17968 |
54.8 |
-0.3 |
0.841 |
0 |
0 |
0 |
0.011 |
13 |
|
[ACE]B:0 |
3 |
1 |
173 |
cf |
B |
x,y,z |
1_555 |
6 |
4 |
17974 |
54.6 |
-0.3 |
0.842 |
0 |
0 |
0 |
0.011 |
Average: |
54.7 |
-0.3 |
0.842 |
0 |
0 |
0 |
0.011 |
9 |
14 |
|
[CIT]A:333 |
3 |
1 |
305 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
17974 |
14.1 |
-0.1 |
0.227 |
0 |
0 |
0 |
0.002 |
15 |
|
[CIT]B:333 |
3 |
1 |
306 |
◊ |
A |
x,y,z |
1_555 |
1 |
1 |
17968 |
13.9 |
-0.1 |
0.236 |
0 |
0 |
0 |
0.002 |
Average: |
14.0 |
-0.1 |
0.232 |
0 |
0 |
0 |
0.002 |
10 |
16 |
|
[ACE]B:0 |
2 |
1 |
173 |
◊ |
A |
-x,-x+y,-z+2/3 |
6_555 |
2 |
1 |
17968 |
12.4 |
-0.1 |
0.535 |
0 |
0 |
0 |
0.004 |
17 |
|
[ACE]A:0 |
2 |
1 |
173 |
◊ |
B |
-x,-x+y,-z+2/3 |
6_555 |
2 |
1 |
17974 |
12.1 |
-0.1 |
0.540 |
0 |
0 |
0 |
0.004 |
Average: |
12.3 |
-0.1 |
0.537 |
0 |
0 |
0 |
0.004 |
11 |
18 |
|
[CIT]B:333 |
2 |
1 |
306 |
◊ |
[CIT]B:333 |
-x,-x+y,-z+2/3 |
6_555 |
2 |
1 |
306 |
9.6 |
0.5 |
0.306 |
0 |
0 |
0 |
0.000 |
19 |
|
[CIT]A:333 |
2 |
1 |
305 |
◊ |
[CIT]A:333 |
-x,-x+y,-z+2/3 |
6_555 |
2 |
1 |
305 |
9.5 |
0.5 |
0.361 |
0 |
0 |
0 |
0.000 |
Average: |
9.6 |
0.5 |
0.333 |
0 |
0 |
0 |
0.000 |
12 |
20 |
|
A |
1 |
1 |
17968 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
1 |
1 |
17974 |
0.8 |
-0.0 |
0.569 |
0 |
0 |
0 |
0.000 |
|