## |
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 |
|
[HEM]D:200 |
40 |
1 |
810 |
f |
D |
x,y,z |
1_555 |
57 |
16 |
6950 |
439.3 |
-16.5 |
0.251 |
3 |
0 |
0 |
0.608 |
2 |
|
[HEM]B:200 |
40 |
1 |
818 |
f |
B |
x,y,z |
1_555 |
61 |
17 |
6980 |
437.8 |
-16.0 |
0.276 |
2 |
0 |
0 |
0.608 |
3 |
|
[HEM]C:200 |
40 |
1 |
803 |
f |
C |
x,y,z |
1_555 |
61 |
17 |
7226 |
430.9 |
-16.9 |
0.231 |
3 |
0 |
0 |
0.608 |
Average: |
436.0 |
-16.5 |
0.253 |
3 |
0 |
0 |
0.608 |
2 |
4 |
|
[HEM]A:200 |
38 |
1 |
823 |
f |
A |
x,y,z |
1_555 |
63 |
16 |
7035 |
431.1 |
-16.3 |
0.261 |
2 |
0 |
0 |
0.251 |
3 |
5 |
|
B |
43 |
13 |
6980 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
48 |
12 |
7035 |
406.6 |
-3.6 |
0.333 |
3 |
0 |
0 |
0.000 |
4 |
6 |
|
D |
40 |
15 |
6950 |
◊ |
A |
x,y,z |
1_555 |
43 |
16 |
7035 |
388.8 |
-5.9 |
0.093 |
0 |
0 |
0 |
0.096 |
7 |
|
C |
39 |
13 |
7226 |
◊ |
B |
x,y,z |
1_555 |
41 |
15 |
6980 |
384.8 |
-6.3 |
0.081 |
0 |
0 |
0 |
0.096 |
Average: |
386.8 |
-6.1 |
0.087 |
0 |
0 |
0 |
0.096 |
5 |
8 |
|
D |
35 |
10 |
6950 |
◊ |
C |
x,y,z |
1_555 |
33 |
10 |
7226 |
286.5 |
-4.4 |
0.203 |
0 |
0 |
0 |
0.074 |
6 |
9 |
|
B |
27 |
10 |
6980 |
◊ |
C |
x-1,y,z |
1_455 |
32 |
11 |
7226 |
269.3 |
-0.8 |
0.534 |
2 |
0 |
0 |
0.000 |
7 |
10 |
|
B |
24 |
10 |
6980 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
31 |
8 |
7035 |
262.2 |
-1.7 |
0.432 |
1 |
0 |
0 |
0.000 |
8 |
11 |
|
B |
31 |
12 |
6980 |
◊ |
C |
-x+1,y-1/2,-z-1/2 |
3_644 |
30 |
10 |
7226 |
245.1 |
2.8 |
0.849 |
1 |
1 |
0 |
0.000 |
9 |
12 |
|
D |
30 |
9 |
6950 |
x |
D |
x-1/2,-y-1/2,-z |
4_445 |
26 |
10 |
6950 |
241.4 |
-0.2 |
0.553 |
2 |
2 |
0 |
0.000 |
10 |
13 |
|
A |
24 |
8 |
7035 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
30 |
11 |
7035 |
231.7 |
2.0 |
0.761 |
2 |
0 |
0 |
0.000 |
11 |
14 |
|
D |
31 |
10 |
6950 |
◊ |
C |
-x+1,y-1/2,-z-1/2 |
3_644 |
15 |
4 |
7226 |
189.9 |
-0.3 |
0.519 |
1 |
1 |
0 |
0.000 |
12 |
15 |
|
[HEM]A:200 |
22 |
1 |
823 |
◊ |
D |
x,y,z |
1_555 |
21 |
8 |
6950 |
176.6 |
-4.6 |
0.588 |
0 |
0 |
0 |
0.068 |
13 |
16 |
|
[HEM]B:200 |
22 |
1 |
818 |
◊ |
C |
x,y,z |
1_555 |
15 |
7 |
7226 |
170.0 |
-4.6 |
0.407 |
0 |
0 |
0 |
0.070 |
17 |
|
[HEM]D:200 |
21 |
1 |
810 |
◊ |
A |
x,y,z |
1_555 |
16 |
7 |
7035 |
164.6 |
-4.5 |
0.427 |
0 |
0 |
0 |
0.070 |
Average: |
167.3 |
-4.6 |
0.417 |
0 |
0 |
0 |
0.070 |
14 |
18 |
|
[HEM]C:200 |
21 |
1 |
803 |
◊ |
B |
x,y,z |
1_555 |
16 |
7 |
6980 |
156.7 |
-4.1 |
0.520 |
0 |
0 |
0 |
0.063 |
15 |
19 |
|
A |
13 |
3 |
7035 |
◊ |
D |
x-1,y,z |
1_455 |
17 |
6 |
6950 |
129.0 |
-1.4 |
0.359 |
1 |
1 |
0 |
0.000 |
16 |
20 |
|
B |
16 |
3 |
6980 |
◊ |
C |
-x,y-1/2,-z-1/2 |
3_544 |
16 |
4 |
7226 |
116.8 |
-0.3 |
0.569 |
1 |
1 |
0 |
0.000 |
17 |
21 |
|
A |
13 |
4 |
7035 |
◊ |
D |
x-1/2,-y-1/2,-z |
4_445 |
12 |
6 |
6950 |
102.1 |
0.6 |
0.694 |
2 |
1 |
0 |
0.000 |
18 |
22 |
|
B |
10 |
4 |
6980 |
◊ |
A |
x,y,z |
1_555 |
11 |
3 |
7035 |
96.6 |
0.8 |
0.738 |
1 |
1 |
0 |
0.000 |
19 |
23 |
|
[HEM]D:200 |
4 |
1 |
810 |
◊ |
[HEM]A:200 |
x,y,z |
1_555 |
10 |
1 |
823 |
64.5 |
-2.1 |
0.825 |
0 |
0 |
0 |
0.030 |
20 |
24 |
|
[HEM]C:200 |
8 |
1 |
803 |
◊ |
[HEM]B:200 |
x,y,z |
1_555 |
5 |
1 |
818 |
53.1 |
-1.7 |
0.926 |
0 |
0 |
0 |
0.026 |
21 |
25 |
|
C |
6 |
2 |
7226 |
x |
C |
-x+1,y-1/2,-z-1/2 |
3_644 |
8 |
3 |
7226 |
50.8 |
0.5 |
0.644 |
0 |
0 |
0 |
0.000 |
22 |
26 |
|
C |
7 |
1 |
7226 |
◊ |
A |
-x+1,y-1/2,-z-1/2 |
3_644 |
5 |
1 |
7035 |
48.3 |
0.3 |
0.674 |
0 |
0 |
0 |
0.000 |
23 |
27 |
|
C |
9 |
4 |
7226 |
◊ |
D |
-x+3/2,-y,z-1/2 |
2_654 |
8 |
6 |
6950 |
47.4 |
0.3 |
0.670 |
0 |
0 |
0 |
0.000 |
24 |
28 |
|
B |
8 |
3 |
6980 |
x |
B |
-x,y-1/2,-z-1/2 |
3_544 |
4 |
2 |
6980 |
45.0 |
-0.3 |
0.319 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
[HEM]B:200 |
5 |
1 |
818 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
5 |
2 |
7035 |
43.2 |
-1.3 |
0.687 |
1 |
0 |
0 |
0.000 |
26 |
30 |
|
[MG]C:95 |
1 |
1 |
98 |
f |
C |
x,y,z |
1_555 |
8 |
3 |
7226 |
42.3 |
-5.1 |
0.000 |
0 |
0 |
0 |
0.149 |
31 |
|
[MG]B:225 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
6980 |
39.6 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.149 |
32 |
|
[MG]A:495 |
1 |
1 |
98 |
f |
A |
x,y,z |
1_555 |
9 |
3 |
7035 |
39.0 |
-4.6 |
0.000 |
0 |
0 |
0 |
0.149 |
33 |
|
[MG]D:460 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
5 |
3 |
6950 |
35.1 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.149 |
Average: |
39.0 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.149 |
27 |
34 |
|
[MG]C:166 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
7 |
4 |
7226 |
39.0 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.142 |
35 |
|
[MG]C:166 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
7 |
3 |
6950 |
38.7 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.142 |
Average: |
38.9 |
-4.2 |
0.000 |
0 |
0 |
0 |
0.142 |
28 |
36 |
|
[MG]D:460 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
7035 |
30.3 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.090 |
37 |
|
[MG]A:495 |
1 |
1 |
98 |
◊ |
D |
x,y,z |
1_555 |
6 |
3 |
6950 |
25.3 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.090 |
38 |
|
[MG]C:95 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
7 |
4 |
6980 |
20.4 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.090 |
39 |
|
[MG]B:225 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
5 |
3 |
7226 |
18.6 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.090 |
Average: |
23.6 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.090 |
29 |
40 |
|
B |
4 |
2 |
6980 |
◊ |
A |
-x+1,y-1/2,-z-1/2 |
3_644 |
3 |
2 |
7035 |
26.7 |
0.7 |
0.809 |
0 |
0 |
0 |
0.000 |
30 |
41 |
|
[MG]D:460 |
1 |
1 |
98 |
f |
[HEM]D:200 |
x,y,z |
1_555 |
3 |
1 |
810 |
11.5 |
-1.6 |
0.000 |
0 |
0 |
0 |
0.027 |
31 |
42 |
|
C |
2 |
2 |
7226 |
◊ |
A |
-x+1/2,-y,z-1/2 |
2_554 |
2 |
2 |
7035 |
4.9 |
0.1 |
0.671 |
0 |
0 |
0 |
0.000 |
32 |
43 |
|
B |
1 |
1 |
6980 |
◊ |
D |
x-1,y,z |
1_455 |
1 |
1 |
6950 |
1.3 |
-0.0 |
0.587 |
0 |
0 |
0 |
0.000 |
33 |
44 |
|
B |
1 |
1 |
6980 |
◊ |
[HEM]A:200 |
-x+1/2,-y,z-1/2 |
2_554 |
1 |
1 |
823 |
0.1 |
-0.0 |
0.807 |
0 |
0 |
0 |
0.000 |
|