| ## |
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 |
|
C |
112 |
32 |
16211 |
◊ |
B |
x,y,z |
1_555 |
102 |
31 |
16198 |
1100.7 |
-11.6 |
0.074 |
11 |
7 |
0 |
0.356 |
2 |
|
B |
114 |
32 |
16198 |
◊ |
A |
x,y,z |
1_555 |
106 |
31 |
16297 |
1100.4 |
-12.1 |
0.078 |
11 |
7 |
0 |
0.356 |
3 |
|
C |
85 |
26 |
16211 |
◊ |
A |
x,y,z |
1_555 |
101 |
27 |
16297 |
967.2 |
-11.3 |
0.074 |
10 |
8 |
0 |
0.356 |
| Average: |
1056.1 |
-11.7 |
0.076 |
11 |
7 |
0 |
0.356 |
| 2 |
4 |
|
A |
66 |
22 |
16297 |
◊ |
C |
-y-1,x-y-1,z-1/3 |
2_444 |
73 |
23 |
16211 |
626.2 |
-2.2 |
0.586 |
3 |
0 |
0 |
0.000 |
| 3 |
5 |
|
C |
70 |
21 |
16211 |
◊ |
B |
-y,x-y,z-1/3 |
2_554 |
66 |
22 |
16198 |
616.5 |
-1.2 |
0.626 |
5 |
7 |
0 |
0.000 |
| 4 |
6 |
|
A |
51 |
23 |
16297 |
◊ |
B |
-y,x-y,z-1/3 |
2_554 |
57 |
19 |
16198 |
438.9 |
-1.1 |
0.619 |
3 |
2 |
0 |
0.000 |
| 5 |
7 |
|
A |
43 |
18 |
16297 |
◊ |
B |
-y-1,x-y,z-1/3 |
2_454 |
40 |
10 |
16198 |
409.4 |
0.2 |
0.650 |
4 |
1 |
0 |
0.000 |
| 6 |
8 |
|
C |
39 |
16 |
16211 |
◊ |
A |
x,y-1,z |
1_545 |
34 |
14 |
16297 |
330.2 |
1.4 |
0.717 |
5 |
0 |
0 |
0.000 |
| 7 |
9 |
|
A |
23 |
9 |
16297 |
◊ |
C |
x-1,y,z |
1_455 |
24 |
7 |
16211 |
222.8 |
-0.3 |
0.629 |
1 |
0 |
0 |
0.000 |
| 8 |
10 |
|
C |
17 |
7 |
16211 |
◊ |
B |
-y,x-y-1,z-1/3 |
2_544 |
17 |
5 |
16198 |
133.6 |
-1.0 |
0.486 |
0 |
0 |
0 |
0.000 |
| 9 |
11 |
|
[ACT]B:653 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
25 |
13 |
16198 |
125.4 |
-0.9 |
0.635 |
3 |
0 |
0 |
0.015 |
| 10 |
12 |
|
[ACT]A:651 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
19 |
11 |
16297 |
116.6 |
-0.8 |
0.644 |
3 |
0 |
0 |
0.014 |
| 11 |
13 |
|
[FES]C:501 |
4 |
1 |
236 |
f |
C |
x,y,z |
1_555 |
16 |
8 |
16211 |
113.2 |
-14.8 |
0.631 |
3 |
0 |
0 |
0.320 |
14 |
|
[FES]B:501 |
4 |
1 |
236 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
16198 |
112.3 |
-14.7 |
0.628 |
2 |
0 |
0 |
0.320 |
15 |
|
[FES]A:501 |
4 |
1 |
237 |
f |
A |
x,y,z |
1_555 |
17 |
9 |
16297 |
111.6 |
-14.6 |
0.640 |
2 |
0 |
0 |
0.320 |
| Average: |
112.4 |
-14.7 |
0.633 |
2 |
0 |
0 |
0.320 |
| 12 |
16 |
|
[ACT]B:652 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
21 |
12 |
16198 |
99.6 |
-2.4 |
0.211 |
2 |
0 |
0 |
0.022 |
| 13 |
17 |
|
[ACT]A:650 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
19 |
12 |
16297 |
94.4 |
-2.1 |
0.243 |
3 |
0 |
0 |
0.023 |
| 14 |
18 |
|
[FE]B:502 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
16198 |
58.2 |
-11.8 |
0.000 |
0 |
0 |
0 |
0.157 |
19 |
|
[FE]A:502 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
11 |
9 |
16297 |
57.2 |
-11.4 |
0.000 |
0 |
0 |
0 |
0.157 |
| Average: |
57.7 |
-11.6 |
0.000 |
0 |
0 |
0 |
0.157 |
| 15 |
20 |
|
[ACT]A:650 |
3 |
1 |
184 |
f |
[FE]A:502 |
x,y,z |
1_555 |
1 |
1 |
137 |
33.7 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.044 |
21 |
|
[ACT]B:652 |
3 |
1 |
183 |
f |
[FE]B:502 |
x,y,z |
1_555 |
1 |
1 |
137 |
31.7 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.044 |
| Average: |
32.7 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.044 |
| 16 |
22 |
|
[FES]A:501 |
3 |
1 |
237 |
◊ |
C |
x,y,z |
1_555 |
3 |
3 |
16211 |
29.6 |
-2.1 |
0.000 |
0 |
0 |
0 |
0.041 |
23 |
|
[FES]B:501 |
3 |
1 |
236 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
16297 |
27.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.041 |
24 |
|
[FES]C:501 |
3 |
1 |
236 |
◊ |
B |
x,y,z |
1_555 |
2 |
2 |
16198 |
27.2 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.041 |
| Average: |
28.1 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.041 |
| 17 |
25 |
|
[ACT]A:651 |
4 |
1 |
181 |
f |
[ACT]A:650 |
x,y,z |
1_555 |
3 |
1 |
184 |
28.0 |
-0.8 |
0.653 |
0 |
0 |
0 |
0.005 |
| 18 |
26 |
|
[ACT]B:653 |
4 |
1 |
182 |
f |
[ACT]B:652 |
x,y,z |
1_555 |
1 |
1 |
183 |
25.0 |
-0.5 |
0.451 |
0 |
0 |
0 |
0.003 |
| 19 |
27 |
|
A |
1 |
1 |
16297 |
◊ |
B |
-y-1,x-y-1,z-1/3 |
2_444 |
1 |
1 |
16198 |
8.3 |
0.4 |
0.892 |
0 |
0 |
0 |
0.000 |
| 20 |
28 |
|
A |
1 |
1 |
16297 |
x |
A |
x,y-1,z |
1_545 |
1 |
1 |
16297 |
4.0 |
-0.0 |
0.530 |
0 |
0 |
0 |
0.000 |
| 21 |
29 |
|
C |
3 |
2 |
16211 |
◊ |
B |
x,y-1,z |
1_545 |
1 |
1 |
16198 |
2.5 |
0.1 |
0.708 |
0 |
0 |
0 |
0.000 |
|