## |
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 |
|
A |
80 |
16 |
10471 |
◊ |
B |
-x+1,-y,z-1 |
2_654 |
82 |
15 |
10651 |
709.1 |
-7.3 |
0.184 |
4 |
0 |
0 |
0.000 |
2 |
2 |
|
[HEM]A:500 |
43 |
1 |
814 |
f |
A |
x,y,z |
1_555 |
88 |
33 |
10471 |
570.7 |
-23.6 |
0.120 |
5 |
0 |
0 |
0.088 |
3 |
|
[HEM]B:503 |
43 |
1 |
820 |
f |
B |
x,y,z |
1_555 |
84 |
32 |
10651 |
570.1 |
-23.9 |
0.106 |
3 |
0 |
0 |
0.088 |
Average: |
570.4 |
-23.7 |
0.113 |
4 |
0 |
0 |
0.088 |
3 |
4 |
|
A |
52 |
18 |
10471 |
◊ |
B |
-x+3/2,y-1/2,-z+2 |
3_647 |
69 |
17 |
10651 |
524.4 |
-10.0 |
0.020 |
0 |
0 |
0 |
0.014 |
4 |
5 |
|
B |
34 |
9 |
10651 |
◊ |
A |
-x+2,-y,z |
2_755 |
35 |
9 |
10471 |
288.2 |
1.2 |
0.702 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
B |
36 |
11 |
10651 |
◊ |
A |
x,y,z |
1_555 |
34 |
9 |
10471 |
284.2 |
3.0 |
0.835 |
3 |
1 |
0 |
0.000 |
6 |
7 |
|
B |
31 |
11 |
10651 |
x |
B |
x,y,z-1 |
1_554 |
23 |
8 |
10651 |
210.3 |
0.4 |
0.581 |
0 |
2 |
0 |
0.000 |
8 |
|
A |
14 |
4 |
10471 |
x |
A |
x,y,z-1 |
1_554 |
17 |
7 |
10471 |
121.9 |
1.0 |
0.705 |
0 |
2 |
0 |
0.000 |
Average: |
166.1 |
0.7 |
0.643 |
0 |
2 |
0 |
0.000 |
7 |
9 |
|
B |
20 |
10 |
10651 |
◊ |
A |
-x+1,-y,z |
2_655 |
20 |
9 |
10471 |
142.3 |
3.6 |
0.902 |
0 |
2 |
0 |
0.000 |
8 |
10 |
|
[XE]B:189 |
1 |
1 |
159 |
f |
B |
x,y,z |
1_555 |
15 |
6 |
10651 |
92.2 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.007 |
11 |
|
[XE]A:189 |
1 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
14 |
6 |
10471 |
91.7 |
-0.9 |
0.000 |
0 |
0 |
0 |
0.007 |
Average: |
92.0 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.007 |
9 |
12 |
|
[ACT]A:191 |
4 |
1 |
184 |
f |
A |
x,y,z |
1_555 |
15 |
6 |
10471 |
91.8 |
-1.3 |
0.459 |
2 |
0 |
0 |
0.007 |
10 |
13 |
|
[XE]A:190 |
1 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
11 |
8 |
10471 |
89.1 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.006 |
14 |
|
[XE]B:190 |
1 |
1 |
159 |
f |
B |
x,y,z |
1_555 |
11 |
7 |
10651 |
87.4 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.006 |
Average: |
88.3 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.006 |
11 |
15 |
|
[OXY]A:501 |
2 |
1 |
127 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
10471 |
55.5 |
0.8 |
0.777 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
[OXY]B:504 |
2 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
11 |
6 |
10651 |
54.4 |
0.8 |
0.777 |
0 |
0 |
0 |
0.000 |
13 |
17 |
|
[OXY]A:501 |
2 |
1 |
127 |
f |
[HEM]A:500 |
x,y,z |
1_555 |
16 |
1 |
814 |
41.7 |
-0.5 |
1.000 |
0 |
0 |
0 |
0.001 |
14 |
18 |
|
[OXY]B:504 |
2 |
1 |
125 |
f |
[HEM]B:503 |
x,y,z |
1_555 |
15 |
1 |
820 |
40.1 |
-0.4 |
1.000 |
0 |
0 |
0 |
0.002 |
15 |
19 |
|
[ACT]A:191 |
3 |
1 |
184 |
◊ |
B |
-x+3/2,y-1/2,-z+2 |
3_647 |
6 |
2 |
10651 |
36.1 |
-0.3 |
0.503 |
0 |
0 |
0 |
0.000 |
16 |
20 |
|
A |
3 |
1 |
10471 |
◊ |
[HEM]B:503 |
-x+3/2,y-1/2,-z+2 |
3_647 |
3 |
1 |
820 |
32.4 |
-1.0 |
0.299 |
0 |
0 |
0 |
0.001 |
17 |
21 |
|
[ACT]A:191 |
3 |
1 |
184 |
f |
[HEM]A:500 |
x,y,z |
1_555 |
3 |
1 |
814 |
32.3 |
-0.8 |
0.711 |
0 |
0 |
0 |
0.003 |
18 |
22 |
|
A |
1 |
1 |
10471 |
◊ |
B |
-x+3/2,y-1/2,-z+1 |
3_646 |
1 |
1 |
10651 |
25.4 |
-0.8 |
0.070 |
0 |
0 |
0 |
0.000 |
19 |
23 |
|
[XE]A:189 |
1 |
1 |
159 |
f |
[HEM]A:500 |
x,y,z |
1_555 |
2 |
1 |
814 |
1.4 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
24 |
|
[XE]B:189 |
1 |
1 |
159 |
f |
[HEM]B:503 |
x,y,z |
1_555 |
1 |
1 |
820 |
0.2 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
Average: |
0.8 |
-0.0 |
0.000 |
0 |
0 |
0 |
0.000 |
|