## |
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 |
|
D |
161 |
46 |
14858 |
◊ |
B |
x,y,z |
1_555 |
166 |
47 |
14763 |
1633.0 |
-10.2 |
0.191 |
36 |
24 |
0 |
0.346 |
2 |
|
C |
124 |
36 |
14344 |
◊ |
A |
x,y,z |
1_555 |
130 |
36 |
14528 |
1214.8 |
-1.9 |
0.562 |
29 |
24 |
0 |
0.346 |
Average: |
1423.9 |
-6.0 |
0.376 |
33 |
24 |
0 |
0.346 |
2 |
3 |
|
B |
173 |
39 |
14763 |
◊ |
A |
x,y,z |
1_555 |
172 |
39 |
14528 |
1616.6 |
-6.3 |
0.362 |
27 |
24 |
0 |
0.302 |
4 |
|
D |
166 |
38 |
14858 |
◊ |
C |
x,y,z |
1_555 |
166 |
37 |
14344 |
1579.6 |
-7.2 |
0.309 |
26 |
24 |
0 |
0.302 |
Average: |
1598.1 |
-6.8 |
0.335 |
27 |
24 |
0 |
0.302 |
3 |
5 |
|
C |
62 |
14 |
14344 |
◊ |
B |
x,y,z |
1_555 |
64 |
14 |
14763 |
490.3 |
-7.0 |
0.092 |
2 |
0 |
0 |
0.073 |
6 |
|
D |
63 |
14 |
14858 |
◊ |
A |
x,y,z |
1_555 |
62 |
14 |
14528 |
484.3 |
-7.0 |
0.087 |
2 |
0 |
0 |
0.073 |
Average: |
487.3 |
-7.0 |
0.090 |
2 |
0 |
0 |
0.073 |
4 |
7 |
|
A |
46 |
13 |
14528 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
45 |
14 |
14763 |
381.7 |
-1.3 |
0.495 |
4 |
4 |
0 |
0.021 |
5 |
8 |
|
[P6G]A:402 |
17 |
1 |
471 |
f |
A |
x,y,z |
1_555 |
32 |
17 |
14528 |
273.4 |
2.3 |
0.470 |
6 |
0 |
0 |
0.015 |
9 |
|
[P6G]B:403 |
17 |
1 |
471 |
f |
B |
x,y,z |
1_555 |
31 |
17 |
14763 |
268.9 |
2.2 |
0.469 |
7 |
0 |
0 |
0.015 |
Average: |
271.2 |
2.3 |
0.470 |
7 |
0 |
0 |
0.015 |
6 |
10 |
|
B |
40 |
10 |
14763 |
◊ |
C |
x,y,z-1 |
1_554 |
28 |
10 |
14344 |
267.5 |
-1.4 |
0.234 |
1 |
0 |
0 |
0.000 |
7 |
11 |
|
[P6G]C:402 |
16 |
1 |
465 |
f |
C |
x,y,z |
1_555 |
30 |
17 |
14344 |
266.7 |
2.4 |
0.492 |
6 |
0 |
0 |
0.009 |
12 |
|
[P6G]D:402 |
16 |
1 |
470 |
f |
D |
x,y,z |
1_555 |
31 |
17 |
14858 |
265.4 |
2.3 |
0.471 |
6 |
0 |
0 |
0.009 |
Average: |
266.1 |
2.3 |
0.481 |
6 |
0 |
0 |
0.009 |
8 |
13 |
|
[P6G]B:406 |
19 |
1 |
543 |
f |
B |
x,y,z |
1_555 |
39 |
15 |
14763 |
254.5 |
2.5 |
0.488 |
2 |
0 |
0 |
0.000 |
14 |
|
[P6G]C:404 |
19 |
1 |
548 |
f |
C |
x,y,z |
1_555 |
37 |
13 |
14344 |
239.3 |
2.0 |
0.395 |
4 |
0 |
0 |
0.000 |
Average: |
246.9 |
2.2 |
0.442 |
3 |
0 |
0 |
0.000 |
9 |
15 |
|
D |
30 |
8 |
14858 |
◊ |
C |
-x,-y,z |
2_555 |
28 |
11 |
14344 |
247.2 |
0.8 |
0.688 |
1 |
1 |
0 |
0.000 |
10 |
16 |
|
D |
14 |
5 |
14858 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
32 |
8 |
14528 |
201.1 |
1.8 |
0.776 |
3 |
1 |
0 |
0.000 |
11 |
17 |
|
A |
26 |
8 |
14528 |
◊ |
[P6G]B:404 |
x-1/2,-y+1/2,-z |
4_455 |
16 |
1 |
570 |
200.2 |
0.0 |
0.230 |
0 |
0 |
0 |
0.000 |
12 |
18 |
|
[P6G]B:404 |
18 |
1 |
570 |
f |
B |
x,y,z |
1_555 |
25 |
8 |
14763 |
198.1 |
-0.1 |
0.202 |
0 |
0 |
0 |
0.002 |
13 |
19 |
|
B |
18 |
6 |
14763 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
17 |
6 |
14528 |
161.8 |
0.3 |
0.617 |
4 |
0 |
0 |
0.000 |
14 |
20 |
|
C |
13 |
4 |
14344 |
◊ |
D |
x-1/2,-y+1/2,-z+1 |
4_456 |
14 |
5 |
14858 |
155.6 |
-0.5 |
0.379 |
3 |
1 |
0 |
0.000 |
15 |
21 |
|
[4NC]C:403 |
11 |
1 |
291 |
f |
C |
x,y,z |
1_555 |
32 |
14 |
14344 |
136.2 |
2.4 |
0.107 |
4 |
0 |
0 |
0.000 |
16 |
22 |
|
B |
8 |
3 |
14763 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
13 |
4 |
14528 |
100.5 |
0.5 |
0.662 |
0 |
1 |
0 |
0.000 |
17 |
23 |
|
[FE2]A:401 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
16 |
9 |
14528 |
76.4 |
-16.9 |
0.000 |
0 |
0 |
0 |
0.435 |
24 |
|
[FE2]B:401 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
15 |
9 |
14763 |
75.8 |
-16.9 |
0.000 |
0 |
0 |
0 |
0.435 |
25 |
|
[FE2]D:401 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
15 |
9 |
14858 |
75.8 |
-16.2 |
0.000 |
0 |
0 |
0 |
0.435 |
26 |
|
[FE2]C:401 |
1 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
15 |
9 |
14344 |
53.3 |
-11.0 |
0.000 |
0 |
0 |
0 |
0.435 |
Average: |
70.3 |
-15.3 |
0.000 |
0 |
0 |
0 |
0.435 |
18 |
27 |
|
[CL]D:403 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
14858 |
73.1 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.308 |
28 |
|
[CL]B:405 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
14763 |
73.0 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.308 |
29 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
14528 |
71.8 |
-11.9 |
0.000 |
0 |
0 |
0 |
0.308 |
30 |
|
[CL]C:405 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
14344 |
49.9 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.308 |
Average: |
67.0 |
-10.8 |
0.000 |
0 |
0 |
0 |
0.308 |
19 |
31 |
|
D |
5 |
3 |
14858 |
◊ |
B |
-x,-y,z |
2_555 |
3 |
2 |
14763 |
47.6 |
0.6 |
0.795 |
0 |
2 |
0 |
0.000 |
20 |
32 |
|
[P6G]C:404 |
4 |
1 |
548 |
◊ |
D |
x,y,z |
1_555 |
5 |
1 |
14858 |
39.8 |
1.9 |
0.758 |
0 |
0 |
0 |
0.000 |
33 |
|
[P6G]B:406 |
3 |
1 |
543 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
14528 |
38.8 |
1.7 |
0.758 |
0 |
0 |
0 |
0.000 |
Average: |
39.3 |
1.8 |
0.758 |
0 |
0 |
0 |
0.000 |
21 |
34 |
|
[4NC]C:403 |
5 |
1 |
291 |
f |
[CL]C:405 |
x,y,z |
1_555 |
1 |
1 |
125 |
39.6 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.048 |
22 |
35 |
|
[4NC]C:403 |
4 |
1 |
291 |
f |
[FE2]C:401 |
x,y,z |
1_555 |
1 |
1 |
137 |
38.3 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.053 |
23 |
36 |
|
[CA]B:402 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
14763 |
35.2 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.068 |
37 |
|
A |
8 |
4 |
14528 |
◊ |
[CA]B:402 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
85 |
34.9 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.068 |
Average: |
35.0 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.068 |
24 |
38 |
|
A |
3 |
3 |
14528 |
◊ |
A |
-x,-y+1,z |
2_565 |
3 |
3 |
14528 |
28.8 |
0.7 |
0.833 |
0 |
0 |
0 |
0.000 |
25 |
39 |
|
D |
1 |
1 |
14858 |
◊ |
[P6G]A:402 |
-x+1/2,y-1/2,-z |
3_545 |
2 |
1 |
471 |
2.2 |
0.1 |
0.570 |
0 |
0 |
0 |
0.000 |
|