| ## |
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 |
89 |
22 |
8025 |
◊ |
C |
x,y,z |
1_555 |
84 |
22 |
7699 |
821.7 |
-10.2 |
0.335 |
9 |
0 |
0 |
0.211 |
2 |
|
B |
88 |
23 |
8101 |
◊ |
A |
x,y,z |
1_555 |
85 |
23 |
7721 |
815.6 |
-10.7 |
0.290 |
7 |
0 |
0 |
0.211 |
| Average: |
818.6 |
-10.5 |
0.312 |
8 |
0 |
0 |
0.211 |
| 2 |
3 |
|
B |
85 |
20 |
8101 |
◊ |
C |
x,y,z |
1_555 |
72 |
18 |
7699 |
674.6 |
-5.2 |
0.589 |
8 |
1 |
0 |
0.128 |
4 |
|
D |
85 |
19 |
8025 |
◊ |
A |
x,y,z |
1_555 |
68 |
17 |
7721 |
672.1 |
-4.5 |
0.643 |
8 |
4 |
0 |
0.128 |
| Average: |
673.4 |
-4.8 |
0.616 |
8 |
3 |
0 |
0.128 |
| 3 |
5 |
|
[HEM]C:142 |
43 |
1 |
844 |
f |
C |
x,y,z |
1_555 |
74 |
27 |
7699 |
602.9 |
-20.7 |
0.426 |
1 |
0 |
0 |
0.308 |
6 |
|
[HEM]A:142 |
43 |
1 |
845 |
f |
A |
x,y,z |
1_555 |
73 |
27 |
7721 |
596.8 |
-19.7 |
0.483 |
1 |
0 |
0 |
0.308 |
| Average: |
599.9 |
-20.2 |
0.455 |
1 |
0 |
0 |
0.308 |
| 4 |
7 |
|
[HEM]B:147 |
43 |
1 |
842 |
f |
B |
x,y,z |
1_555 |
65 |
25 |
8101 |
574.0 |
-20.2 |
0.251 |
1 |
0 |
0 |
0.315 |
| 5 |
8 |
|
[HEM]D:147 |
43 |
1 |
839 |
f |
D |
x,y,z |
1_555 |
63 |
23 |
8025 |
557.1 |
-18.8 |
0.281 |
0 |
0 |
0 |
0.281 |
| 6 |
9 |
|
C |
31 |
9 |
7699 |
◊ |
A |
x,y,z |
1_555 |
29 |
9 |
7721 |
281.8 |
4.1 |
0.957 |
6 |
4 |
0 |
0.000 |
| 7 |
10 |
|
A |
30 |
9 |
7721 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
27 |
10 |
8025 |
265.1 |
-2.2 |
0.561 |
3 |
0 |
0 |
0.000 |
| 8 |
11 |
|
D |
20 |
5 |
8025 |
◊ |
B |
x-1/2,-y+1/2,-z |
4_455 |
33 |
10 |
8101 |
257.3 |
-2.8 |
0.306 |
4 |
2 |
0 |
0.000 |
| 9 |
12 |
|
D |
24 |
9 |
8025 |
◊ |
A |
x-1,y,z |
1_455 |
23 |
8 |
7721 |
195.2 |
-1.4 |
0.582 |
1 |
1 |
0 |
0.000 |
| 10 |
13 |
|
[L35]C:1200 |
22 |
1 |
582 |
f |
A |
x,y,z |
1_555 |
22 |
8 |
7721 |
189.3 |
-7.4 |
0.649 |
1 |
0 |
0 |
0.120 |
14 |
|
[L35]A:1201 |
18 |
1 |
588 |
f |
C |
x,y,z |
1_555 |
22 |
7 |
7699 |
175.1 |
-9.2 |
0.427 |
0 |
0 |
0 |
0.120 |
| Average: |
182.2 |
-8.3 |
0.538 |
1 |
0 |
0 |
0.120 |
| 11 |
15 |
|
[L35]D:1202 |
16 |
1 |
592 |
f |
D |
x,y,z |
1_555 |
22 |
7 |
8025 |
166.3 |
-4.6 |
0.683 |
2 |
0 |
0 |
0.081 |
| 12 |
16 |
|
D |
22 |
8 |
8025 |
◊ |
B |
x-1,y,z |
1_455 |
20 |
6 |
8101 |
165.4 |
0.5 |
0.772 |
2 |
0 |
0 |
0.000 |
| 13 |
17 |
|
[L35]C:1200 |
21 |
1 |
582 |
◊ |
B |
x,y,z |
1_555 |
18 |
6 |
8101 |
163.5 |
-3.0 |
0.610 |
0 |
0 |
0 |
0.046 |
18 |
|
[L35]A:1201 |
19 |
1 |
588 |
◊ |
D |
x,y,z |
1_555 |
12 |
6 |
8025 |
131.3 |
-1.2 |
0.615 |
0 |
0 |
0 |
0.046 |
| Average: |
147.4 |
-2.1 |
0.612 |
0 |
0 |
0 |
0.046 |
| 14 |
19 |
|
B |
17 |
6 |
8101 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
23 |
6 |
7721 |
148.1 |
-0.3 |
0.704 |
1 |
0 |
0 |
0.000 |
| 15 |
20 |
|
[L35]C:1200 |
10 |
1 |
582 |
◊ |
C |
x,y,z |
1_555 |
17 |
5 |
7699 |
131.7 |
-1.4 |
0.644 |
0 |
0 |
0 |
0.017 |
21 |
|
[L35]A:1201 |
11 |
1 |
588 |
◊ |
A |
x,y,z |
1_555 |
17 |
5 |
7721 |
131.0 |
-1.5 |
0.660 |
0 |
0 |
0 |
0.017 |
| Average: |
131.4 |
-1.4 |
0.652 |
0 |
0 |
0 |
0.017 |
| 16 |
22 |
|
D |
13 |
5 |
8025 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
14 |
5 |
8101 |
117.8 |
-2.1 |
0.326 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
C |
9 |
5 |
7699 |
◊ |
B |
x-1/2,-y-1/2,-z |
4_445 |
10 |
5 |
8101 |
91.0 |
0.4 |
0.566 |
0 |
0 |
0 |
0.000 |
| 18 |
24 |
|
[L35]D:1202 |
11 |
1 |
592 |
◊ |
[L35]A:1201 |
x,y,z |
1_555 |
12 |
1 |
588 |
85.3 |
-4.4 |
0.635 |
0 |
0 |
0 |
0.057 |
| 19 |
25 |
|
[L35]D:1202 |
7 |
1 |
592 |
◊ |
A |
x,y,z |
1_555 |
7 |
3 |
7721 |
75.1 |
-2.2 |
0.294 |
0 |
0 |
0 |
0.032 |
| 20 |
26 |
|
[L35]D:1202 |
11 |
1 |
592 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
8101 |
73.6 |
0.1 |
0.772 |
2 |
0 |
0 |
0.004 |
| 21 |
27 |
|
C |
10 |
5 |
7699 |
◊ |
D |
-x-1/2,-y,z-1/2 |
2_454 |
5 |
2 |
8025 |
73.3 |
-0.2 |
0.572 |
0 |
0 |
0 |
0.000 |
| 22 |
28 |
|
C |
9 |
5 |
7699 |
x |
C |
x-1/2,-y-1/2,-z |
4_445 |
9 |
4 |
7699 |
70.9 |
0.5 |
0.781 |
0 |
0 |
0 |
0.000 |
| 23 |
29 |
|
C |
13 |
5 |
7699 |
◊ |
A |
x-1/2,-y-1/2,-z |
4_445 |
4 |
3 |
7721 |
53.8 |
-1.0 |
0.295 |
0 |
0 |
0 |
0.000 |
| 24 |
30 |
|
C |
6 |
2 |
7699 |
◊ |
A |
x-1,y,z |
1_455 |
9 |
4 |
7721 |
53.7 |
-1.0 |
0.432 |
0 |
0 |
0 |
0.000 |
| 25 |
31 |
|
[L35]D:1202 |
5 |
1 |
592 |
◊ |
[L35]C:1200 |
x,y,z |
1_555 |
4 |
1 |
582 |
51.9 |
-3.9 |
0.361 |
0 |
0 |
0 |
0.059 |
| 26 |
32 |
|
A |
3 |
1 |
7721 |
◊ |
[HEM]D:147 |
-x,y-1/2,-z+1/2 |
3_545 |
4 |
1 |
839 |
38.4 |
-0.8 |
0.750 |
1 |
0 |
0 |
0.000 |
| 27 |
33 |
|
C |
4 |
2 |
7699 |
◊ |
D |
-x,y-1/2,-z+1/2 |
3_545 |
3 |
3 |
8025 |
36.5 |
-0.5 |
0.442 |
0 |
0 |
0 |
0.000 |
| 28 |
34 |
|
B |
2 |
1 |
8101 |
◊ |
[HEM]A:142 |
-x+1/2,-y,z-1/2 |
2_554 |
3 |
1 |
845 |
31.6 |
-0.2 |
0.661 |
2 |
0 |
0 |
0.000 |
| 29 |
35 |
|
[L35]D:1202 |
2 |
1 |
592 |
◊ |
C |
x,y,z |
1_555 |
3 |
2 |
7699 |
27.7 |
-3.2 |
0.214 |
0 |
0 |
0 |
0.041 |
| 30 |
36 |
|
B |
4 |
2 |
8101 |
x |
B |
x-1/2,-y+1/2,-z |
4_455 |
3 |
2 |
8101 |
21.0 |
0.7 |
0.839 |
0 |
0 |
0 |
0.000 |
| 31 |
37 |
|
[HEM]C:142 |
1 |
1 |
844 |
◊ |
B |
x,y,z |
1_555 |
1 |
1 |
8101 |
5.5 |
0.1 |
0.863 |
0 |
0 |
0 |
0.000 |
38 |
|
[HEM]A:142 |
1 |
1 |
845 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
8025 |
4.0 |
0.1 |
0.884 |
0 |
0 |
0 |
0.000 |
| Average: |
4.7 |
0.1 |
0.874 |
0 |
0 |
0 |
0.000 |
| 32 |
39 |
|
D |
1 |
1 |
8025 |
◊ |
[HEM]B:147 |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
842 |
0.5 |
-0.0 |
0.807 |
0 |
0 |
0 |
0.000 |
|