## |
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 |
84 |
23 |
7814 |
◊ |
A |
x,y,z |
1_555 |
96 |
24 |
7755 |
879.3 |
-8.7 |
0.386 |
6 |
0 |
0 |
0.205 |
2 |
|
D |
91 |
24 |
7860 |
◊ |
C |
x,y,z |
1_555 |
94 |
24 |
7581 |
867.7 |
-8.0 |
0.439 |
8 |
0 |
0 |
0.205 |
Average: |
873.5 |
-8.3 |
0.412 |
7 |
0 |
0 |
0.205 |
2 |
3 |
|
[HEM]A:142 |
43 |
1 |
839 |
f |
A |
x,y,z |
1_555 |
74 |
26 |
7755 |
592.1 |
-20.8 |
0.289 |
2 |
0 |
0 |
0.372 |
4 |
|
[HEM]C:142 |
43 |
1 |
844 |
f |
C |
x,y,z |
1_555 |
75 |
27 |
7581 |
588.4 |
-20.0 |
0.379 |
2 |
0 |
0 |
0.372 |
Average: |
590.3 |
-20.4 |
0.334 |
2 |
0 |
0 |
0.372 |
3 |
5 |
|
[HEM]B:147 |
42 |
1 |
840 |
f |
B |
x,y,z |
1_555 |
64 |
24 |
7814 |
561.8 |
-19.2 |
0.247 |
0 |
0 |
0 |
0.330 |
6 |
|
[HEM]D:147 |
43 |
1 |
840 |
f |
D |
x,y,z |
1_555 |
66 |
24 |
7860 |
554.2 |
-18.6 |
0.303 |
0 |
0 |
0 |
0.330 |
Average: |
558.0 |
-18.9 |
0.275 |
0 |
0 |
0 |
0.330 |
4 |
7 |
|
D |
61 |
13 |
7860 |
◊ |
A |
x,y,z |
1_555 |
50 |
14 |
7755 |
485.4 |
-2.7 |
0.619 |
2 |
0 |
0 |
0.060 |
8 |
|
B |
61 |
13 |
7814 |
◊ |
C |
x,y,z |
1_555 |
46 |
12 |
7581 |
474.0 |
-2.3 |
0.643 |
4 |
0 |
0 |
0.060 |
Average: |
479.7 |
-2.5 |
0.631 |
3 |
0 |
0 |
0.060 |
5 |
9 |
|
C |
38 |
14 |
7581 |
◊ |
A |
x,y,z |
1_555 |
39 |
14 |
7755 |
356.8 |
-3.9 |
0.427 |
5 |
0 |
0 |
0.048 |
6 |
10 |
|
A |
27 |
7 |
7755 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
23 |
11 |
7581 |
232.6 |
-2.4 |
0.460 |
1 |
0 |
0 |
0.000 |
7 |
11 |
|
C |
20 |
5 |
7581 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
29 |
13 |
7755 |
217.2 |
-0.3 |
0.689 |
1 |
1 |
0 |
0.000 |
8 |
12 |
|
B |
20 |
8 |
7814 |
x |
B |
-x-1,y-1/2,-z-1/2 |
3_444 |
20 |
5 |
7814 |
210.8 |
-0.6 |
0.639 |
1 |
4 |
0 |
0.000 |
9 |
13 |
|
D |
20 |
6 |
7860 |
◊ |
B |
x,y,z |
1_555 |
19 |
5 |
7814 |
157.4 |
-0.5 |
0.644 |
1 |
0 |
0 |
0.007 |
10 |
14 |
|
B |
17 |
7 |
7814 |
◊ |
D |
-x-1/2,-y,z-1/2 |
2_454 |
24 |
7 |
7860 |
157.1 |
-1.0 |
0.552 |
1 |
3 |
0 |
0.000 |
11 |
15 |
|
A |
18 |
7 |
7755 |
◊ |
D |
x-1/2,-y+1/2,-z |
4_455 |
13 |
5 |
7860 |
136.0 |
0.7 |
0.773 |
1 |
0 |
0 |
0.000 |
12 |
16 |
|
B |
15 |
6 |
7814 |
◊ |
A |
-x-1,y-1/2,-z-1/2 |
3_444 |
15 |
5 |
7755 |
117.7 |
0.4 |
0.741 |
1 |
2 |
0 |
0.000 |
13 |
17 |
|
D |
11 |
5 |
7860 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
11 |
3 |
7755 |
90.5 |
0.4 |
0.701 |
1 |
1 |
0 |
0.000 |
14 |
18 |
|
D |
11 |
4 |
7860 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
11 |
3 |
7581 |
89.3 |
0.0 |
0.684 |
0 |
0 |
0 |
0.000 |
15 |
19 |
|
[CMO]D:148 |
2 |
1 |
137 |
f |
D |
x,y,z |
1_555 |
10 |
7 |
7860 |
65.9 |
-0.3 |
0.750 |
0 |
0 |
0 |
0.005 |
16 |
20 |
|
[HEM]C:142 |
6 |
1 |
844 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
6 |
3 |
7755 |
65.4 |
-4.0 |
0.274 |
0 |
0 |
0 |
0.000 |
17 |
21 |
|
[CMO]B:148 |
2 |
1 |
137 |
f |
B |
x,y,z |
1_555 |
9 |
7 |
7814 |
64.5 |
-0.4 |
0.742 |
0 |
0 |
0 |
0.003 |
18 |
22 |
|
C |
10 |
4 |
7581 |
◊ |
B |
-x,y-1/2,-z-1/2 |
3_544 |
8 |
3 |
7814 |
64.1 |
0.3 |
0.725 |
1 |
0 |
0 |
0.000 |
19 |
23 |
|
[CMO]C:143 |
2 |
1 |
137 |
f |
C |
x,y,z |
1_555 |
9 |
7 |
7581 |
64.0 |
-1.0 |
0.589 |
0 |
0 |
0 |
0.018 |
20 |
24 |
|
[CMO]A:143 |
2 |
1 |
136 |
f |
A |
x,y,z |
1_555 |
10 |
7 |
7755 |
63.7 |
-1.1 |
0.590 |
0 |
0 |
0 |
0.009 |
21 |
25 |
|
[CMO]A:143 |
2 |
1 |
136 |
f |
[HEM]A:142 |
x,y,z |
1_555 |
19 |
1 |
839 |
43.2 |
-1.9 |
0.866 |
0 |
0 |
0 |
0.015 |
22 |
26 |
|
[CMO]C:143 |
2 |
1 |
137 |
f |
[HEM]C:142 |
x,y,z |
1_555 |
18 |
1 |
844 |
42.5 |
-2.0 |
0.866 |
0 |
0 |
0 |
0.035 |
23 |
27 |
|
[CMO]D:148 |
1 |
1 |
137 |
f |
[HEM]D:147 |
x,y,z |
1_555 |
21 |
1 |
840 |
42.0 |
-2.0 |
0.707 |
0 |
0 |
0 |
0.036 |
24 |
28 |
|
D |
4 |
2 |
7860 |
◊ |
C |
x-1/2,-y-1/2,-z |
4_445 |
5 |
2 |
7581 |
41.3 |
-0.8 |
0.342 |
0 |
0 |
0 |
0.000 |
25 |
29 |
|
[CMO]B:148 |
2 |
1 |
137 |
f |
[HEM]B:147 |
x,y,z |
1_555 |
16 |
1 |
840 |
41.2 |
-1.9 |
0.866 |
0 |
0 |
0 |
0.015 |
26 |
30 |
|
D |
7 |
5 |
7860 |
x |
D |
x-1/2,-y-1/2,-z |
4_445 |
5 |
2 |
7860 |
28.9 |
-0.2 |
0.579 |
0 |
0 |
0 |
0.000 |
27 |
31 |
|
B |
1 |
1 |
7814 |
◊ |
C |
x-1,y,z |
1_455 |
1 |
1 |
7581 |
8.6 |
-0.0 |
0.479 |
0 |
0 |
0 |
0.000 |
28 |
32 |
|
B |
3 |
1 |
7814 |
◊ |
A |
-x,y-1/2,-z-1/2 |
3_544 |
1 |
1 |
7755 |
6.1 |
0.3 |
0.797 |
0 |
0 |
0 |
0.000 |
29 |
33 |
|
A |
1 |
1 |
7755 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
7755 |
5.7 |
-0.0 |
0.517 |
0 |
0 |
0 |
0.000 |
30 |
34 |
|
[HEM]A:142 |
2 |
1 |
839 |
◊ |
C |
x-1/2,-y+1/2,-z |
4_455 |
2 |
2 |
7581 |
5.0 |
-0.4 |
0.630 |
0 |
0 |
0 |
0.000 |
31 |
35 |
|
[HEM]D:147 |
1 |
1 |
840 |
◊ |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
7755 |
3.8 |
-0.1 |
0.651 |
0 |
0 |
0 |
0.000 |
|