| ## |
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 |
164 |
46 |
14773 |
◊ |
B |
x,y,z |
1_555 |
168 |
47 |
14811 |
1631.8 |
-8.7 |
0.250 |
36 |
24 |
0 |
0.335 |
2 |
|
C |
131 |
36 |
14475 |
◊ |
A |
x,y,z |
1_555 |
136 |
37 |
14614 |
1283.3 |
-2.4 |
0.507 |
30 |
24 |
0 |
0.335 |
| Average: |
1457.5 |
-5.6 |
0.378 |
33 |
24 |
0 |
0.335 |
| 2 |
3 |
|
B |
176 |
39 |
14811 |
◊ |
A |
x,y,z |
1_555 |
169 |
38 |
14614 |
1622.3 |
-7.2 |
0.299 |
29 |
25 |
0 |
0.316 |
4 |
|
D |
167 |
38 |
14773 |
◊ |
C |
x,y,z |
1_555 |
165 |
37 |
14475 |
1579.6 |
-7.8 |
0.270 |
26 |
24 |
0 |
0.316 |
| Average: |
1600.9 |
-7.5 |
0.285 |
28 |
25 |
0 |
0.316 |
| 3 |
5 |
|
C |
61 |
14 |
14475 |
◊ |
B |
x,y,z |
1_555 |
64 |
14 |
14811 |
491.5 |
-8.5 |
0.042 |
2 |
0 |
0 |
0.081 |
6 |
|
D |
62 |
14 |
14773 |
◊ |
A |
x,y,z |
1_555 |
63 |
14 |
14614 |
486.8 |
-7.0 |
0.080 |
2 |
0 |
0 |
0.081 |
| Average: |
489.1 |
-7.8 |
0.061 |
2 |
0 |
0 |
0.081 |
| 4 |
7 |
|
A |
46 |
13 |
14614 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
45 |
14 |
14811 |
386.8 |
-1.2 |
0.491 |
4 |
4 |
0 |
0.050 |
| 5 |
8 |
|
[P6G]A:402 |
16 |
1 |
469 |
f |
A |
x,y,z |
1_555 |
30 |
17 |
14614 |
272.4 |
2.6 |
0.514 |
6 |
0 |
0 |
0.008 |
9 |
|
[P6G]B:403 |
17 |
1 |
469 |
f |
B |
x,y,z |
1_555 |
31 |
17 |
14811 |
269.3 |
2.3 |
0.466 |
6 |
0 |
0 |
0.008 |
10 |
|
[P6G]C:402 |
16 |
1 |
466 |
f |
C |
x,y,z |
1_555 |
30 |
17 |
14475 |
268.4 |
2.2 |
0.494 |
6 |
0 |
0 |
0.008 |
| Average: |
270.0 |
2.4 |
0.491 |
6 |
0 |
0 |
0.008 |
| 6 |
11 |
|
B |
43 |
12 |
14811 |
◊ |
C |
x,y,z-1 |
1_554 |
28 |
10 |
14475 |
270.0 |
-1.3 |
0.232 |
3 |
0 |
0 |
0.000 |
| 7 |
12 |
|
[P6G]D:402 |
17 |
1 |
466 |
f |
D |
x,y,z |
1_555 |
30 |
17 |
14773 |
263.1 |
2.2 |
0.443 |
6 |
0 |
0 |
0.006 |
| 8 |
13 |
|
D |
30 |
10 |
14773 |
◊ |
C |
-x,-y,z |
2_555 |
28 |
12 |
14475 |
247.8 |
0.6 |
0.668 |
1 |
2 |
0 |
0.000 |
| 9 |
14 |
|
[P6G]B:404 |
18 |
1 |
568 |
f |
B |
x,y,z |
1_555 |
27 |
8 |
14811 |
201.3 |
-0.4 |
0.191 |
0 |
0 |
0 |
0.005 |
| 10 |
15 |
|
A |
27 |
8 |
14614 |
◊ |
[P6G]B:404 |
x-1/2,-y+1/2,-z |
4_455 |
18 |
1 |
568 |
200.3 |
0.1 |
0.219 |
0 |
0 |
0 |
0.000 |
| 11 |
16 |
|
D |
14 |
5 |
14773 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
29 |
8 |
14614 |
173.5 |
1.0 |
0.726 |
3 |
1 |
0 |
0.003 |
| 12 |
17 |
|
B |
18 |
6 |
14811 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
17 |
5 |
14614 |
163.8 |
0.0 |
0.569 |
3 |
0 |
0 |
0.000 |
| 13 |
18 |
|
[PG4]B:406 |
12 |
1 |
417 |
◊ |
B |
x,y,z |
1_555 |
23 |
10 |
14811 |
163.7 |
5.0 |
0.392 |
3 |
0 |
0 |
0.000 |
| 14 |
19 |
|
C |
15 |
4 |
14475 |
◊ |
D |
x-1/2,-y+1/2,-z+1 |
4_456 |
14 |
5 |
14773 |
154.8 |
-0.6 |
0.381 |
2 |
1 |
0 |
0.000 |
| 15 |
20 |
|
[4NC]C:403 |
11 |
1 |
293 |
f |
C |
x,y,z |
1_555 |
31 |
14 |
14475 |
137.9 |
2.7 |
0.118 |
7 |
0 |
0 |
0.010 |
21 |
|
[4NC]D:403 |
11 |
1 |
288 |
f |
D |
x,y,z |
1_555 |
31 |
14 |
14773 |
135.5 |
2.4 |
0.118 |
6 |
0 |
0 |
0.010 |
| Average: |
136.7 |
2.5 |
0.118 |
7 |
0 |
0 |
0.010 |
| 16 |
22 |
|
[PEG]C:404 |
6 |
1 |
263 |
f |
C |
x,y,z |
1_555 |
17 |
9 |
14475 |
121.5 |
3.8 |
0.468 |
1 |
0 |
0 |
0.000 |
| 17 |
23 |
|
B |
7 |
3 |
14811 |
◊ |
A |
-x+1/2,y-1/2,-z |
3_545 |
12 |
3 |
14614 |
93.0 |
0.4 |
0.551 |
0 |
1 |
0 |
0.000 |
| 18 |
24 |
|
[FE2]B:401 |
1 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
14 |
9 |
14811 |
76.3 |
-16.9 |
0.000 |
0 |
0 |
0 |
0.459 |
25 |
|
[FE2]A:401 |
1 |
1 |
137 |
f |
A |
x,y,z |
1_555 |
14 |
9 |
14614 |
75.9 |
-16.2 |
0.000 |
0 |
0 |
0 |
0.459 |
26 |
|
[FE2]D:401 |
1 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
13 |
9 |
14773 |
53.7 |
-10.5 |
0.000 |
0 |
0 |
0 |
0.459 |
27 |
|
[FE2]C:401 |
1 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
12 |
9 |
14475 |
53.6 |
-10.4 |
0.000 |
0 |
0 |
0 |
0.459 |
| Average: |
64.9 |
-13.5 |
0.000 |
0 |
0 |
0 |
0.459 |
| 19 |
28 |
|
[CL]B:405 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
14811 |
72.8 |
-12.1 |
0.000 |
0 |
0 |
0 |
0.325 |
29 |
|
[CL]A:403 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
14614 |
72.6 |
-11.3 |
0.000 |
0 |
0 |
0 |
0.325 |
30 |
|
[CL]C:405 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
12 |
7 |
14475 |
50.6 |
-7.9 |
0.000 |
0 |
0 |
0 |
0.325 |
31 |
|
[CL]D:404 |
1 |
1 |
125 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
14773 |
50.4 |
-8.0 |
0.000 |
0 |
0 |
0 |
0.325 |
| Average: |
61.6 |
-9.8 |
0.000 |
0 |
0 |
0 |
0.325 |
| 20 |
32 |
|
D |
6 |
3 |
14773 |
◊ |
B |
-x,-y,z |
2_555 |
4 |
2 |
14811 |
44.5 |
1.4 |
0.829 |
1 |
2 |
0 |
0.000 |
| 21 |
33 |
|
[4NC]C:403 |
5 |
1 |
293 |
f |
[CL]C:405 |
x,y,z |
1_555 |
1 |
1 |
125 |
39.8 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.095 |
34 |
|
[4NC]D:403 |
5 |
1 |
288 |
f |
[CL]D:404 |
x,y,z |
1_555 |
1 |
1 |
125 |
39.1 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.095 |
| Average: |
39.4 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.095 |
| 22 |
35 |
|
[4NC]C:403 |
4 |
1 |
293 |
f |
[FE2]C:401 |
x,y,z |
1_555 |
1 |
1 |
137 |
37.7 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.105 |
36 |
|
[4NC]D:403 |
4 |
1 |
288 |
f |
[FE2]D:401 |
x,y,z |
1_555 |
1 |
1 |
137 |
37.7 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.105 |
| Average: |
37.7 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.105 |
| 23 |
37 |
|
[PG4]B:406 |
2 |
1 |
417 |
f |
A |
x,y,z |
1_555 |
6 |
2 |
14614 |
35.2 |
0.6 |
0.390 |
0 |
0 |
0 |
0.000 |
| 24 |
38 |
|
[CA]B:402 |
1 |
1 |
85 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
14811 |
34.9 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.165 |
39 |
|
A |
8 |
4 |
14614 |
◊ |
[CA]B:402 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
85 |
34.8 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.165 |
| Average: |
34.9 |
-5.9 |
0.000 |
0 |
0 |
0 |
0.165 |
| 25 |
40 |
|
A |
5 |
3 |
14614 |
◊ |
A |
-x,-y+1,z |
2_565 |
5 |
3 |
14614 |
24.3 |
0.2 |
0.652 |
0 |
0 |
0 |
0.000 |
| 26 |
41 |
|
D |
1 |
1 |
14773 |
◊ |
[P6G]A:402 |
-x+1/2,y-1/2,-z |
3_545 |
1 |
1 |
469 |
0.7 |
0.0 |
0.583 |
0 |
0 |
0 |
0.000 |
|