| ## |
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 |
104 |
30 |
8356 |
◊ |
A |
x,y,z |
1_555 |
97 |
29 |
8333 |
964.6 |
-12.5 |
0.181 |
10 |
0 |
0 |
0.543 |
2 |
|
C |
102 |
30 |
8305 |
◊ |
C |
y,x,-z |
4_555 |
100 |
30 |
8305 |
963.8 |
-12.6 |
0.189 |
12 |
0 |
0 |
0.543 |
| Average: |
964.2 |
-12.6 |
0.185 |
11 |
0 |
0 |
0.543 |
| 2 |
3 |
|
C |
83 |
22 |
8305 |
◊ |
A |
y,x,-z |
4_555 |
75 |
20 |
8333 |
757.6 |
-1.2 |
0.680 |
9 |
2 |
0 |
0.227 |
4 |
|
C |
76 |
21 |
8305 |
◊ |
B |
x,y,z |
1_555 |
84 |
22 |
8356 |
728.0 |
-2.6 |
0.656 |
9 |
1 |
0 |
0.227 |
5 |
|
B |
72 |
20 |
8356 |
◊ |
A |
y,x,-z |
4_555 |
81 |
22 |
8333 |
698.0 |
-3.9 |
0.546 |
5 |
1 |
0 |
0.227 |
| Average: |
727.9 |
-2.6 |
0.627 |
8 |
1 |
0 |
0.227 |
| 3 |
6 |
|
A |
54 |
15 |
8333 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
53 |
15 |
8356 |
546.1 |
-12.5 |
0.028 |
0 |
0 |
0 |
0.332 |
| 4 |
7 |
|
C |
55 |
13 |
8305 |
◊ |
C |
x-y,-y,-z+1/3 |
5_555 |
55 |
13 |
8305 |
515.6 |
-6.5 |
0.282 |
8 |
2 |
0 |
0.041 |
| 5 |
8 |
|
[DTT]B:152 |
8 |
1 |
296 |
f |
B |
x,y,z |
1_555 |
24 |
12 |
8356 |
172.3 |
-3.1 |
0.528 |
5 |
0 |
0 |
0.143 |
| 6 |
9 |
|
A |
15 |
4 |
8333 |
◊ |
A |
y,x,-z |
4_555 |
15 |
4 |
8333 |
147.1 |
-1.7 |
0.393 |
2 |
0 |
0 |
0.045 |
10 |
|
C |
15 |
3 |
8305 |
◊ |
B |
y,x,-z |
4_555 |
14 |
3 |
8356 |
145.7 |
-1.4 |
0.441 |
2 |
0 |
0 |
0.045 |
| Average: |
146.4 |
-1.6 |
0.417 |
2 |
0 |
0 |
0.045 |
| 7 |
11 |
|
[PO4]C:152 |
5 |
1 |
189 |
f |
C |
x,y,z |
1_555 |
16 |
10 |
8305 |
114.8 |
-5.3 |
0.849 |
5 |
0 |
0 |
0.457 |
| 8 |
12 |
|
A |
11 |
3 |
8333 |
x |
A |
-y+1,x-y+1,z-1/3 |
2_664 |
13 |
5 |
8333 |
110.9 |
0.6 |
0.648 |
0 |
0 |
0 |
0.000 |
| 9 |
13 |
|
[PO4]A:152 |
5 |
1 |
187 |
f |
A |
x,y,z |
1_555 |
18 |
10 |
8333 |
107.1 |
-6.3 |
0.747 |
4 |
0 |
0 |
0.215 |
| 10 |
14 |
|
[PO4]A:153 |
5 |
1 |
188 |
f |
A |
x,y,z |
1_555 |
21 |
9 |
8333 |
106.5 |
-6.8 |
0.759 |
5 |
0 |
0 |
0.240 |
| 11 |
15 |
|
C |
8 |
2 |
8305 |
◊ |
B |
-y+1,x-y,z-1/3 |
2_654 |
10 |
4 |
8356 |
81.7 |
-0.1 |
0.508 |
1 |
0 |
0 |
0.000 |
| 12 |
16 |
|
A |
4 |
2 |
8333 |
◊ |
[DTT]B:152 |
x-y,-y+1,-z+1/3 |
5_565 |
4 |
1 |
296 |
36.0 |
0.9 |
0.552 |
0 |
0 |
0 |
0.000 |
| 13 |
17 |
|
[PO4]A:153 |
3 |
1 |
188 |
f |
[PO4]A:152 |
x,y,z |
1_555 |
3 |
1 |
187 |
35.9 |
-3.5 |
0.896 |
0 |
0 |
0 |
0.093 |
| 14 |
18 |
|
[PO4]A:152 |
1 |
1 |
187 |
◊ |
B |
x-y,-y+1,-z+1/3 |
5_565 |
1 |
1 |
8356 |
1.0 |
-0.1 |
0.640 |
0 |
0 |
0 |
0.002 |
|