| ## |
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 |
415 |
105 |
20114 |
◊ |
A |
x,y,z |
1_555 |
410 |
107 |
20211 |
3895.7 |
-32.6 |
0.295 |
50 |
15 |
0 |
0.110 |
| 2 |
2 |
|
A |
66 |
21 |
20211 |
x |
A |
y,x-1,-z |
4_545 |
60 |
22 |
20211 |
557.3 |
-0.9 |
0.716 |
6 |
0 |
0 |
0.000 |
| 3 |
3 |
|
[JRH]A:1205 |
36 |
1 |
710 |
f |
A |
x,y,z |
1_555 |
79 |
32 |
20211 |
488.6 |
-2.8 |
0.544 |
9 |
0 |
0 |
0.027 |
4 |
|
[JRH]B:903 |
36 |
1 |
707 |
f |
B |
x,y,z |
1_555 |
76 |
32 |
20114 |
483.5 |
-2.9 |
0.536 |
9 |
0 |
0 |
0.027 |
| Average: |
486.0 |
-2.9 |
0.540 |
9 |
0 |
0 |
0.027 |
| 4 |
5 |
|
B |
43 |
15 |
20114 |
x |
B |
x-y-1,-y-1,-z+1/3 |
5_445 |
47 |
15 |
20114 |
417.6 |
-1.4 |
0.593 |
5 |
0 |
0 |
0.000 |
| 5 |
6 |
|
A |
26 |
8 |
20211 |
◊ |
A |
y,x,-z |
4_555 |
26 |
8 |
20211 |
203.3 |
-1.1 |
0.587 |
2 |
0 |
0 |
0.000 |
| 6 |
7 |
|
A |
16 |
5 |
20211 |
x |
A |
x-1,y-1,z |
1_445 |
15 |
6 |
20211 |
137.9 |
-0.3 |
0.631 |
0 |
1 |
0 |
0.000 |
| 7 |
8 |
|
B |
15 |
6 |
20114 |
◊ |
A |
x-1,y,z |
1_455 |
15 |
7 |
20211 |
130.6 |
-0.6 |
0.590 |
0 |
0 |
0 |
0.000 |
| 8 |
9 |
|
A |
13 |
4 |
20211 |
x |
A |
x-1,y,z |
1_455 |
14 |
6 |
20211 |
125.5 |
0.7 |
0.764 |
2 |
0 |
0 |
0.000 |
| 9 |
10 |
|
B |
18 |
6 |
20114 |
x |
B |
x-1,y,z |
1_455 |
10 |
4 |
20114 |
109.0 |
0.3 |
0.717 |
2 |
0 |
0 |
0.000 |
| 10 |
11 |
|
[K]B:904 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
15 |
8 |
20114 |
102.5 |
-83.0 |
0.000 |
0 |
0 |
0 |
0.321 |
12 |
|
[K]A:1206 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
14 |
8 |
20211 |
101.7 |
-82.8 |
0.000 |
0 |
0 |
0 |
0.321 |
| Average: |
102.1 |
-82.9 |
0.000 |
0 |
0 |
0 |
0.321 |
| 11 |
13 |
|
[ACT]B:902 |
4 |
1 |
180 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
20114 |
100.8 |
0.4 |
0.781 |
3 |
0 |
0 |
0.002 |
| 12 |
14 |
|
[ACT]B:901 |
4 |
1 |
179 |
f |
B |
x,y,z |
1_555 |
14 |
4 |
20114 |
88.9 |
-1.2 |
0.556 |
0 |
0 |
0 |
0.002 |
| 13 |
15 |
|
[ACT]A:1202 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
20211 |
85.8 |
1.4 |
0.859 |
4 |
0 |
0 |
0.000 |
| 14 |
16 |
|
[K]A:1207 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
16 |
11 |
20211 |
83.6 |
-70.4 |
0.000 |
0 |
0 |
0 |
0.272 |
17 |
|
[K]B:905 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
14 |
11 |
20114 |
83.0 |
-70.2 |
0.000 |
0 |
0 |
0 |
0.272 |
| Average: |
83.3 |
-70.3 |
0.000 |
0 |
0 |
0 |
0.272 |
| 15 |
18 |
|
[ACT]A:1203 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
17 |
6 |
20211 |
78.7 |
-1.1 |
0.541 |
0 |
0 |
0 |
0.002 |
| 16 |
19 |
|
[ACT]A:1201 |
4 |
1 |
184 |
◊ |
A |
x,y,z |
1_555 |
14 |
4 |
20211 |
72.6 |
0.4 |
0.750 |
2 |
0 |
0 |
0.000 |
| 17 |
20 |
|
[ACT]A:1204 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
7 |
3 |
20211 |
56.0 |
-0.2 |
0.706 |
0 |
0 |
0 |
0.000 |
| 18 |
21 |
|
[K]B:904 |
1 |
1 |
216 |
◊ |
A |
x,y,z |
1_555 |
10 |
4 |
20211 |
55.4 |
-24.9 |
0.000 |
0 |
0 |
0 |
0.097 |
22 |
|
[K]A:1206 |
1 |
1 |
216 |
◊ |
B |
x,y,z |
1_555 |
10 |
4 |
20114 |
55.2 |
-25.0 |
0.000 |
0 |
0 |
0 |
0.097 |
| Average: |
55.3 |
-25.0 |
0.000 |
0 |
0 |
0 |
0.097 |
| 19 |
23 |
|
[K]B:905 |
1 |
1 |
216 |
f |
[JRH]B:903 |
x,y,z |
1_555 |
8 |
1 |
707 |
53.5 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.098 |
24 |
|
[K]A:1207 |
1 |
1 |
216 |
f |
[JRH]A:1205 |
x,y,z |
1_555 |
8 |
1 |
710 |
53.4 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.098 |
| Average: |
53.4 |
-25.4 |
0.000 |
0 |
0 |
0 |
0.098 |
| 20 |
25 |
|
A |
10 |
3 |
20211 |
f |
[ACT]A:1201 |
y,x-1,-z |
4_545 |
4 |
1 |
184 |
53.1 |
-0.8 |
0.622 |
0 |
0 |
0 |
0.002 |
| 21 |
26 |
|
[MN]A:1208 |
1 |
1 |
123 |
f |
A |
x,y,z |
1_555 |
12 |
8 |
20211 |
39.8 |
-3.0 |
0.000 |
0 |
0 |
0 |
0.013 |
27 |
|
[MN]B:906 |
1 |
1 |
123 |
f |
B |
x,y,z |
1_555 |
10 |
9 |
20114 |
39.3 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.013 |
| Average: |
39.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.013 |
| 22 |
28 |
|
[ACT]A:1204 |
4 |
1 |
182 |
◊ |
A |
y,x,-z |
4_555 |
5 |
3 |
20211 |
36.4 |
0.6 |
0.831 |
0 |
0 |
0 |
0.000 |
| 23 |
29 |
|
[ACT]B:901 |
4 |
1 |
179 |
◊ |
B |
x-y-1,-y-1,-z+1/3 |
5_445 |
7 |
2 |
20114 |
33.7 |
0.2 |
0.706 |
0 |
0 |
0 |
0.000 |
| 24 |
30 |
|
[MN]B:906 |
1 |
1 |
123 |
f |
[JRH]B:903 |
x,y,z |
1_555 |
3 |
1 |
707 |
28.7 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.003 |
31 |
|
[MN]A:1208 |
1 |
1 |
123 |
f |
[JRH]A:1205 |
x,y,z |
1_555 |
3 |
1 |
710 |
28.5 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.003 |
| Average: |
28.6 |
-0.8 |
0.000 |
0 |
0 |
0 |
0.003 |
| 25 |
32 |
|
[MN]B:906 |
1 |
1 |
123 |
f |
[K]B:905 |
x,y,z |
1_555 |
1 |
1 |
216 |
25.1 |
-12.9 |
0.000 |
0 |
0 |
0 |
0.025 |
| 26 |
33 |
|
[MN]A:1208 |
1 |
1 |
123 |
f |
[K]A:1207 |
x,y,z |
1_555 |
1 |
1 |
216 |
25.1 |
-12.7 |
0.000 |
0 |
0 |
0 |
0.025 |
| 27 |
34 |
|
B |
1 |
1 |
20114 |
◊ |
A |
x-1,y-1,z |
1_445 |
2 |
1 |
20211 |
2.6 |
-0.0 |
0.648 |
0 |
0 |
0 |
0.000 |
|