| ## |
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 |
112 |
34 |
10639 |
◊ |
B |
x,-y-1,-z |
3_545 |
112 |
34 |
10639 |
1074.3 |
-1.1 |
0.704 |
12 |
0 |
0 |
0.000 |
2 |
|
A |
118 |
35 |
10588 |
◊ |
A |
-x-1,y,-z+1/2 |
4_455 |
118 |
35 |
10588 |
1017.2 |
6.1 |
0.934 |
18 |
0 |
0 |
0.000 |
| Average: |
1045.8 |
2.5 |
0.819 |
15 |
0 |
0 |
0.000 |
| 2 |
3 |
|
B |
60 |
21 |
10639 |
◊ |
A |
x,y,z |
1_555 |
60 |
17 |
10588 |
579.2 |
-7.8 |
0.133 |
3 |
0 |
0 |
0.000 |
4 |
|
B |
59 |
19 |
10639 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
60 |
20 |
10588 |
578.5 |
-7.6 |
0.146 |
2 |
0 |
0 |
0.000 |
| Average: |
578.8 |
-7.7 |
0.140 |
3 |
0 |
0 |
0.000 |
| 3 |
5 |
|
[08C]A:2165 |
19 |
1 |
442 |
f |
A |
x,y,z |
1_555 |
54 |
18 |
10588 |
317.7 |
2.9 |
0.408 |
4 |
0 |
0 |
0.000 |
6 |
|
[08C]B:2165 |
19 |
1 |
441 |
f |
B |
x,y,z |
1_555 |
54 |
18 |
10639 |
313.6 |
2.9 |
0.416 |
4 |
0 |
0 |
0.000 |
| Average: |
315.7 |
2.9 |
0.412 |
4 |
0 |
0 |
0.000 |
| 4 |
7 |
|
[PEG]A:2167 |
7 |
1 |
259 |
◊ |
A |
x,y,z |
1_555 |
29 |
9 |
10588 |
144.6 |
2.9 |
0.383 |
3 |
0 |
0 |
0.000 |
| 5 |
8 |
|
[GOL]A:2169 |
6 |
1 |
217 |
f |
A |
x,y,z |
1_555 |
26 |
9 |
10588 |
142.4 |
-1.0 |
0.460 |
2 |
0 |
0 |
0.005 |
9 |
|
[GOL]B:2166 |
6 |
1 |
217 |
f |
B |
x,y,z |
1_555 |
25 |
9 |
10639 |
139.8 |
-1.0 |
0.460 |
2 |
0 |
0 |
0.005 |
| Average: |
141.1 |
-1.0 |
0.460 |
2 |
0 |
0 |
0.005 |
| 6 |
10 |
|
[SO4]B:2163 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
23 |
11 |
10639 |
119.3 |
-17.8 |
0.768 |
9 |
0 |
0 |
0.054 |
| 7 |
11 |
|
[SO4]A:2164 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
10588 |
112.0 |
-16.2 |
0.760 |
4 |
0 |
0 |
0.044 |
| 8 |
12 |
|
[GOL]A:2168 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
14 |
7 |
10588 |
110.1 |
-0.4 |
0.532 |
4 |
0 |
0 |
0.005 |
| 9 |
13 |
|
[SO4]B:2164 |
5 |
1 |
186 |
f |
B |
x,y,z |
1_555 |
18 |
6 |
10639 |
109.4 |
-15.7 |
0.744 |
4 |
0 |
0 |
0.044 |
| 10 |
14 |
|
[SO4]A:2163 |
5 |
1 |
186 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
10588 |
103.1 |
-15.7 |
0.824 |
6 |
0 |
0 |
0.045 |
| 11 |
15 |
|
B |
10 |
3 |
10639 |
◊ |
A |
-x-1,y,-z+1/2 |
4_455 |
6 |
2 |
10588 |
93.6 |
-1.1 |
0.252 |
1 |
1 |
0 |
0.000 |
| 12 |
16 |
|
B |
10 |
4 |
10639 |
◊ |
A |
x-1/2,-y-1/2,-z |
7_445 |
11 |
3 |
10588 |
89.9 |
-1.5 |
0.291 |
1 |
1 |
0 |
0.000 |
| 13 |
17 |
|
[GOL]A:2166 |
6 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
18 |
6 |
10588 |
84.3 |
-0.1 |
0.615 |
3 |
0 |
0 |
0.003 |
| 14 |
18 |
|
[GOL]A:2166 |
5 |
1 |
216 |
◊ |
A |
-x-1,y,-z+1/2 |
4_455 |
15 |
6 |
10588 |
69.1 |
0.3 |
0.658 |
1 |
0 |
0 |
0.000 |
| 15 |
19 |
|
[GOL]A:2166 |
5 |
1 |
216 |
◊ |
[GOL]A:2166 |
-x-1,y,-z+1/2 |
4_455 |
5 |
1 |
216 |
59.1 |
-0.0 |
0.595 |
0 |
0 |
0 |
0.000 |
| 16 |
20 |
|
A |
8 |
3 |
10588 |
◊ |
A |
x,-y,-z |
3_555 |
8 |
3 |
10588 |
55.2 |
0.2 |
0.667 |
0 |
0 |
0 |
0.000 |
| 17 |
21 |
|
[GOL]A:2168 |
5 |
1 |
216 |
◊ |
A |
-x-1,y,-z+1/2 |
4_455 |
4 |
2 |
10588 |
37.3 |
-0.8 |
0.296 |
0 |
0 |
0 |
0.000 |
| 18 |
22 |
|
B |
3 |
1 |
10639 |
◊ |
B |
-x-1,y,-z+1/2 |
4_455 |
3 |
1 |
10639 |
25.4 |
-0.8 |
0.236 |
0 |
0 |
0 |
0.000 |
| 19 |
23 |
|
[GOL]A:2168 |
1 |
1 |
216 |
◊ |
B |
-x-1,y,-z+1/2 |
4_455 |
4 |
1 |
10639 |
22.2 |
-0.0 |
0.422 |
0 |
0 |
0 |
0.000 |
| 20 |
24 |
|
[SO4]A:2163 |
1 |
1 |
186 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
10639 |
10.2 |
-1.1 |
0.807 |
0 |
0 |
0 |
0.000 |
| 21 |
25 |
|
[PEG]A:2167 |
1 |
1 |
259 |
f |
A |
-x-1,y,-z+1/2 |
4_455 |
2 |
1 |
10588 |
10.1 |
-0.3 |
0.268 |
0 |
0 |
0 |
0.000 |
| 22 |
26 |
|
[SO4]B:2163 |
1 |
1 |
186 |
◊ |
A |
x-1/2,y-1/2,z |
5_445 |
1 |
1 |
10588 |
7.4 |
-0.9 |
0.799 |
0 |
0 |
0 |
0.000 |
|