## |
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 |
|
B |
73 |
19 |
5998 |
◊ |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
84 |
22 |
5916 |
723.2 |
-0.3 |
0.686 |
9 |
1 |
0 |
0.000 |
2 |
|
D |
68 |
19 |
6046 |
◊ |
C |
x,y,z |
1_555 |
60 |
17 |
5916 |
640.1 |
-2.0 |
0.540 |
6 |
2 |
0 |
0.000 |
3 |
|
B |
74 |
21 |
5998 |
◊ |
A |
x,y,z |
1_555 |
52 |
16 |
6113 |
590.9 |
0.9 |
0.760 |
8 |
2 |
0 |
0.000 |
Average: |
651.4 |
-0.5 |
0.662 |
8 |
2 |
0 |
0.000 |
2 |
4 |
|
[HEM]B:201 |
40 |
1 |
821 |
f |
B |
x,y,z |
1_555 |
63 |
23 |
5998 |
510.0 |
-20.4 |
0.120 |
2 |
0 |
0 |
0.725 |
5 |
|
[HEM]D:201 |
40 |
1 |
809 |
f |
D |
x,y,z |
1_555 |
62 |
23 |
6046 |
508.7 |
-20.1 |
0.100 |
2 |
0 |
0 |
0.725 |
6 |
|
[HEM]A:201 |
39 |
1 |
802 |
f |
A |
x,y,z |
1_555 |
63 |
24 |
6113 |
504.0 |
-19.7 |
0.098 |
2 |
0 |
0 |
0.725 |
7 |
|
[HEM]C:201 |
40 |
1 |
814 |
f |
C |
x,y,z |
1_555 |
65 |
23 |
5916 |
500.7 |
-19.7 |
0.104 |
2 |
0 |
0 |
0.725 |
Average: |
505.9 |
-20.0 |
0.106 |
2 |
0 |
0 |
0.725 |
3 |
8 |
|
A |
66 |
21 |
6113 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
54 |
17 |
6046 |
497.6 |
-0.5 |
0.631 |
3 |
0 |
0 |
0.000 |
4 |
9 |
|
A |
55 |
20 |
6113 |
◊ |
D |
x-1,y,z |
1_455 |
44 |
12 |
6046 |
444.6 |
-0.4 |
0.552 |
8 |
0 |
0 |
0.000 |
5 |
10 |
|
B |
43 |
12 |
5998 |
◊ |
C |
x,y-1,z |
1_545 |
44 |
12 |
5916 |
406.6 |
-5.2 |
0.210 |
4 |
0 |
0 |
0.000 |
6 |
11 |
|
A |
25 |
6 |
6113 |
◊ |
D |
x-1,y-1,z |
1_445 |
33 |
8 |
6046 |
288.2 |
-1.1 |
0.454 |
3 |
0 |
0 |
0.000 |
7 |
12 |
|
B |
26 |
9 |
5998 |
◊ |
D |
x-1,y-1,z |
1_445 |
34 |
9 |
6046 |
233.2 |
0.5 |
0.691 |
2 |
0 |
0 |
0.000 |
8 |
13 |
|
C |
29 |
10 |
5916 |
◊ |
B |
x,y,z |
1_555 |
16 |
4 |
5998 |
215.3 |
-0.8 |
0.546 |
1 |
0 |
0 |
0.000 |
14 |
|
D |
16 |
4 |
6046 |
◊ |
A |
x,y,z |
1_555 |
29 |
11 |
6113 |
199.9 |
0.0 |
0.638 |
3 |
0 |
0 |
0.000 |
Average: |
207.6 |
-0.4 |
0.592 |
2 |
0 |
0 |
0.000 |
9 |
15 |
|
C |
21 |
7 |
5916 |
◊ |
A |
x,y,z |
1_555 |
26 |
8 |
6113 |
206.8 |
-0.9 |
0.547 |
0 |
0 |
0 |
0.000 |
10 |
16 |
|
A |
20 |
7 |
6113 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
17 |
7 |
6113 |
173.6 |
2.5 |
0.871 |
3 |
4 |
0 |
0.000 |
11 |
17 |
|
B |
17 |
8 |
5998 |
◊ |
C |
x-1,y,z |
1_455 |
15 |
6 |
5916 |
148.2 |
-1.7 |
0.340 |
0 |
0 |
0 |
0.029 |
12 |
18 |
|
B |
16 |
4 |
5998 |
◊ |
C |
x-1,y-1,z |
1_445 |
12 |
5 |
5916 |
128.8 |
-0.5 |
0.420 |
0 |
0 |
0 |
0.000 |
13 |
19 |
|
A |
15 |
4 |
6113 |
◊ |
[HEM]A:201 |
x-1,y,z |
1_455 |
10 |
1 |
802 |
105.1 |
-3.6 |
0.562 |
0 |
0 |
0 |
0.000 |
14 |
20 |
|
B |
11 |
5 |
5998 |
◊ |
[HEM]C:201 |
x-1,y,z |
1_455 |
7 |
1 |
814 |
95.3 |
-3.9 |
0.409 |
2 |
0 |
0 |
0.084 |
15 |
21 |
|
[HEM]B:201 |
6 |
1 |
821 |
◊ |
C |
x-1,y,z |
1_455 |
11 |
5 |
5916 |
94.5 |
-3.8 |
0.358 |
1 |
0 |
0 |
0.073 |
16 |
22 |
|
A |
8 |
3 |
6113 |
x |
A |
x-1,y,z |
1_455 |
8 |
4 |
6113 |
88.4 |
-1.7 |
0.227 |
0 |
0 |
0 |
0.000 |
17 |
23 |
|
[MG]D:303 |
1 |
1 |
98 |
f |
D |
x,y,z |
1_555 |
8 |
3 |
6046 |
40.9 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.061 |
24 |
|
[MG]A:301 |
1 |
1 |
98 |
f |
B |
x,y,z |
1_555 |
7 |
3 |
5998 |
32.1 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.061 |
Average: |
36.5 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.061 |
18 |
25 |
|
A |
7 |
2 |
6113 |
◊ |
D |
x,y-1,z |
1_545 |
6 |
3 |
6046 |
40.8 |
-0.1 |
0.555 |
0 |
0 |
0 |
0.000 |
19 |
26 |
|
[MG]A:301 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
9 |
3 |
6113 |
33.4 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.000 |
27 |
|
[MG]D:303 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
5916 |
32.5 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
33.0 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
C |
4 |
2 |
5916 |
x |
C |
-x+1,y-1/2,-z+1/2 |
3_645 |
2 |
2 |
5916 |
31.7 |
1.5 |
0.876 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[MG]A:304 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
6113 |
29.1 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.000 |
22 |
30 |
|
[HEM]B:201 |
2 |
1 |
821 |
◊ |
[HEM]C:201 |
x-1,y,z |
1_455 |
3 |
1 |
814 |
28.1 |
-1.6 |
0.482 |
0 |
0 |
0 |
0.028 |
23 |
31 |
|
[MG]A:304 |
1 |
1 |
98 |
f |
A |
x-1/2,-y+1/2,-z |
4_455 |
6 |
2 |
6113 |
27.9 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.014 |
24 |
32 |
|
[MG]A:301 |
1 |
1 |
98 |
◊ |
C |
x,y,z |
1_555 |
4 |
2 |
5916 |
20.5 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.000 |
33 |
|
[MG]D:303 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
2 |
6113 |
19.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
19.9 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.000 |
25 |
34 |
|
A |
3 |
1 |
6113 |
◊ |
[HEM]D:201 |
x,y-1,z |
1_545 |
2 |
1 |
809 |
18.9 |
-0.5 |
0.597 |
0 |
0 |
0 |
0.000 |
26 |
35 |
|
A |
5 |
2 |
6113 |
◊ |
D |
x-3/2,-y+1/2,-z |
4_355 |
4 |
1 |
6046 |
18.5 |
-0.1 |
0.538 |
0 |
0 |
0 |
0.000 |
27 |
36 |
|
B |
3 |
2 |
5998 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
6046 |
12.3 |
0.0 |
0.616 |
0 |
0 |
0 |
0.000 |
28 |
37 |
|
[MG]A:304 |
1 |
1 |
98 |
◊ |
D |
x-1,y,z |
1_455 |
3 |
3 |
6046 |
12.0 |
-1.3 |
0.000 |
0 |
0 |
0 |
0.000 |
29 |
38 |
|
B |
2 |
2 |
5998 |
◊ |
D |
x-1,y,z |
1_455 |
4 |
1 |
6046 |
8.1 |
0.0 |
0.616 |
0 |
0 |
0 |
0.000 |
30 |
39 |
|
A |
2 |
2 |
6113 |
◊ |
C |
x-1,y,z |
1_455 |
2 |
2 |
5916 |
4.7 |
-0.1 |
0.557 |
0 |
0 |
0 |
0.000 |
31 |
40 |
|
[HEM]D:201 |
1 |
1 |
809 |
◊ |
D |
x-1/2,-y+3/2,-z |
4_465 |
1 |
1 |
6046 |
3.9 |
-0.3 |
0.457 |
0 |
0 |
0 |
0.000 |
32 |
41 |
|
[HEM]C:201 |
2 |
1 |
814 |
◊ |
A |
x,y,z |
1_555 |
2 |
2 |
6113 |
3.6 |
-0.2 |
0.689 |
0 |
0 |
0 |
0.000 |
42 |
|
[HEM]A:201 |
1 |
1 |
802 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
5916 |
2.4 |
-0.2 |
0.519 |
0 |
0 |
0 |
0.000 |
Average: |
3.0 |
-0.2 |
0.604 |
0 |
0 |
0 |
0.000 |
33 |
43 |
|
D |
1 |
1 |
6046 |
x |
D |
x-1,y,z |
1_455 |
2 |
1 |
6046 |
3.6 |
-0.0 |
0.624 |
0 |
0 |
0 |
0.000 |
34 |
44 |
|
[HEM]C:201 |
2 |
1 |
814 |
◊ |
[HEM]A:201 |
x,y,z |
1_555 |
2 |
1 |
802 |
3.1 |
-0.1 |
0.991 |
0 |
0 |
0 |
0.000 |
35 |
45 |
|
B |
1 |
1 |
5998 |
x |
B |
x-1,y,z |
1_455 |
1 |
1 |
5998 |
0.4 |
0.0 |
0.662 |
0 |
0 |
0 |
0.000 |
|