| ## |
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]B:200 |
41 |
1 |
801 |
f |
B |
x,y,z |
1_555 |
59 |
16 |
7104 |
455.5 |
-15.6 |
0.344 |
4 |
0 |
0 |
0.100 |
2 |
|
[HEM]A:200 |
40 |
1 |
806 |
f |
A |
x,y,z |
1_555 |
58 |
17 |
7081 |
449.5 |
-15.8 |
0.326 |
4 |
0 |
0 |
0.100 |
| Average: |
452.5 |
-15.7 |
0.335 |
4 |
0 |
0 |
0.100 |
| 2 |
3 |
|
[HEM]D:200 |
40 |
1 |
819 |
f |
D |
x,y,z |
1_555 |
60 |
17 |
7439 |
445.2 |
-15.4 |
0.233 |
2 |
0 |
0 |
0.717 |
4 |
|
[HEM]C:200 |
40 |
1 |
817 |
f |
C |
x,y,z |
1_555 |
63 |
17 |
7137 |
443.5 |
-15.2 |
0.287 |
2 |
0 |
0 |
0.717 |
| Average: |
444.4 |
-15.3 |
0.260 |
2 |
0 |
0 |
0.717 |
| 3 |
5 |
|
D |
47 |
14 |
7439 |
x |
D |
-x+1,y-1/2,-z |
2_645 |
42 |
13 |
7439 |
431.1 |
2.2 |
0.645 |
6 |
2 |
0 |
0.000 |
6 |
|
C |
32 |
10 |
7137 |
x |
C |
-x,y-1/2,-z |
2_545 |
38 |
14 |
7137 |
314.0 |
-0.2 |
0.466 |
3 |
2 |
0 |
0.000 |
| Average: |
372.6 |
1.0 |
0.555 |
5 |
2 |
0 |
0.000 |
| 4 |
7 |
|
D |
39 |
12 |
7439 |
◊ |
C |
x,y,z |
1_555 |
39 |
12 |
7137 |
387.6 |
-0.6 |
0.427 |
4 |
2 |
0 |
0.059 |
| 5 |
8 |
|
D |
37 |
8 |
7439 |
◊ |
A |
x,y,z |
1_555 |
45 |
16 |
7081 |
366.5 |
-1.2 |
0.300 |
3 |
0 |
0 |
0.000 |
| 6 |
9 |
|
B |
40 |
12 |
7104 |
◊ |
A |
-x,y-1/2,-z+1 |
2_546 |
37 |
9 |
7081 |
322.9 |
4.4 |
0.861 |
6 |
2 |
0 |
0.000 |
| 7 |
10 |
|
C |
37 |
12 |
7137 |
◊ |
D |
x,y-1,z |
1_545 |
33 |
8 |
7439 |
310.9 |
-0.7 |
0.399 |
6 |
0 |
0 |
0.000 |
| 8 |
11 |
|
C |
29 |
10 |
7137 |
◊ |
B |
x,y,z |
1_555 |
33 |
14 |
7104 |
277.0 |
0.8 |
0.590 |
2 |
1 |
0 |
0.000 |
| 9 |
12 |
|
B |
27 |
10 |
7104 |
◊ |
A |
x-1,y-1,z |
1_445 |
22 |
9 |
7081 |
254.0 |
-0.3 |
0.470 |
0 |
0 |
0 |
0.000 |
| 10 |
13 |
|
A |
33 |
10 |
7081 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
28 |
9 |
7081 |
242.0 |
0.3 |
0.565 |
3 |
0 |
0 |
0.000 |
| 11 |
14 |
|
C |
23 |
6 |
7137 |
◊ |
A |
x,y,z |
1_555 |
23 |
8 |
7081 |
203.4 |
-0.6 |
0.411 |
7 |
0 |
0 |
0.000 |
| 12 |
15 |
|
B |
22 |
5 |
7104 |
◊ |
A |
x,y,z |
1_555 |
23 |
5 |
7081 |
198.8 |
-1.0 |
0.372 |
4 |
0 |
0 |
0.000 |
| 13 |
16 |
|
[HEM]C:200 |
19 |
1 |
817 |
◊ |
D |
x,y,z |
1_555 |
23 |
9 |
7439 |
172.2 |
-4.3 |
0.673 |
0 |
0 |
0 |
0.182 |
17 |
|
[HEM]D:200 |
19 |
1 |
819 |
◊ |
C |
x,y,z |
1_555 |
23 |
8 |
7137 |
168.1 |
-3.9 |
0.706 |
0 |
0 |
0 |
0.182 |
| Average: |
170.2 |
-4.1 |
0.689 |
0 |
0 |
0 |
0.182 |
| 14 |
18 |
|
C |
17 |
5 |
7137 |
◊ |
D |
-x+1,y-1/2,-z |
2_645 |
17 |
4 |
7439 |
151.9 |
0.5 |
0.537 |
2 |
0 |
0 |
0.000 |
19 |
|
C |
17 |
4 |
7137 |
◊ |
D |
-x,y-1/2,-z |
2_545 |
15 |
5 |
7439 |
142.5 |
0.5 |
0.561 |
1 |
0 |
0 |
0.000 |
| Average: |
147.2 |
0.5 |
0.549 |
2 |
0 |
0 |
0.000 |
| 15 |
20 |
|
[HEM]A:200 |
16 |
1 |
806 |
◊ |
B |
x,y,z |
1_555 |
15 |
4 |
7104 |
117.9 |
-2.3 |
0.724 |
0 |
0 |
0 |
0.000 |
21 |
|
[HEM]B:200 |
14 |
1 |
801 |
◊ |
A |
x,y,z |
1_555 |
15 |
4 |
7081 |
110.6 |
-2.2 |
0.693 |
0 |
0 |
0 |
0.000 |
| Average: |
114.3 |
-2.3 |
0.708 |
0 |
0 |
0 |
0.000 |
| 16 |
22 |
|
[HEM]A:200 |
5 |
1 |
806 |
◊ |
C |
x,y,z |
1_555 |
10 |
2 |
7137 |
66.7 |
-1.8 |
0.448 |
0 |
0 |
0 |
0.000 |
| 17 |
23 |
|
[HEM]D:200 |
6 |
1 |
819 |
◊ |
[HEM]C:200 |
x,y,z |
1_555 |
5 |
1 |
817 |
59.9 |
-1.9 |
0.881 |
0 |
0 |
0 |
0.042 |
| 18 |
24 |
|
B |
8 |
3 |
7104 |
◊ |
D |
x,y-1,z |
1_545 |
2 |
1 |
7439 |
40.0 |
1.0 |
0.811 |
0 |
0 |
0 |
0.000 |
| 19 |
25 |
|
[HEM]B:200 |
1 |
1 |
801 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
7137 |
5.0 |
-0.2 |
0.500 |
0 |
0 |
0 |
0.000 |
| 20 |
26 |
|
B |
1 |
1 |
7104 |
◊ |
A |
x,y-1,z |
1_545 |
1 |
1 |
7081 |
2.1 |
0.0 |
0.693 |
0 |
0 |
0 |
0.000 |
|