## |
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 |
|
F |
91 |
23 |
8067 |
◊ |
E |
x,y,z |
1_555 |
90 |
23 |
7633 |
856.5 |
-9.7 |
0.401 |
8 |
0 |
0 |
0.260 |
2 |
|
B |
87 |
22 |
8077 |
◊ |
A |
x,y,z |
1_555 |
85 |
22 |
7734 |
853.1 |
-10.5 |
0.312 |
9 |
0 |
0 |
0.260 |
3 |
|
D |
88 |
22 |
8001 |
◊ |
C |
x,y,z |
1_555 |
88 |
22 |
7875 |
850.3 |
-11.1 |
0.292 |
10 |
0 |
0 |
0.260 |
Average: |
853.3 |
-10.4 |
0.335 |
9 |
0 |
0 |
0.260 |
2 |
4 |
|
[HEM]C:201 |
43 |
1 |
837 |
f |
C |
x,y,z |
1_555 |
67 |
27 |
7875 |
564.8 |
-20.1 |
0.199 |
0 |
0 |
0 |
0.352 |
5 |
|
[HEM]E:201 |
43 |
1 |
826 |
f |
E |
x,y,z |
1_555 |
63 |
25 |
7633 |
564.5 |
-19.9 |
0.177 |
0 |
0 |
0 |
0.352 |
6 |
|
[HEM]A:201 |
43 |
1 |
839 |
f |
A |
x,y,z |
1_555 |
67 |
25 |
7734 |
558.2 |
-19.7 |
0.211 |
0 |
0 |
0 |
0.352 |
Average: |
562.5 |
-19.9 |
0.195 |
0 |
0 |
0 |
0.352 |
3 |
7 |
|
[HEM]B:201 |
43 |
1 |
832 |
f |
B |
x,y,z |
1_555 |
65 |
25 |
8077 |
560.3 |
-18.6 |
0.411 |
0 |
0 |
0 |
0.321 |
8 |
|
[HEM]D:201 |
43 |
1 |
821 |
f |
D |
x,y,z |
1_555 |
65 |
25 |
8001 |
556.0 |
-18.5 |
0.384 |
0 |
0 |
0 |
0.321 |
9 |
|
[HEM]F:201 |
43 |
1 |
816 |
f |
F |
x,y,z |
1_555 |
64 |
24 |
8067 |
546.9 |
-18.2 |
0.399 |
0 |
0 |
0 |
0.321 |
Average: |
554.4 |
-18.4 |
0.398 |
0 |
0 |
0 |
0.321 |
4 |
10 |
|
F |
66 |
15 |
8067 |
◊ |
E |
x-y,-y,-z-1/3 |
5_554 |
64 |
17 |
7633 |
554.8 |
-5.5 |
0.524 |
5 |
0 |
0 |
0.120 |
11 |
|
B |
62 |
14 |
8077 |
◊ |
C |
x,y,z |
1_555 |
63 |
16 |
7875 |
541.6 |
-3.6 |
0.622 |
6 |
0 |
0 |
0.120 |
12 |
|
D |
67 |
14 |
8001 |
◊ |
A |
x,y,z |
1_555 |
59 |
16 |
7734 |
522.3 |
-4.1 |
0.614 |
4 |
0 |
0 |
0.120 |
Average: |
539.6 |
-4.4 |
0.587 |
5 |
0 |
0 |
0.120 |
5 |
13 |
|
A |
39 |
13 |
7734 |
◊ |
F |
-y,x-y,z+1/3 |
2_555 |
32 |
12 |
8067 |
365.5 |
-7.5 |
0.099 |
1 |
0 |
0 |
0.116 |
14 |
|
C |
37 |
12 |
7875 |
◊ |
B |
-x+1,-x+y,-z+1/3 |
6_655 |
37 |
12 |
8077 |
365.4 |
-7.4 |
0.119 |
1 |
0 |
0 |
0.116 |
15 |
|
E |
39 |
13 |
7633 |
◊ |
D |
y,x-1,-z |
4_545 |
33 |
12 |
8001 |
357.5 |
-6.9 |
0.117 |
2 |
0 |
0 |
0.116 |
Average: |
362.8 |
-7.3 |
0.112 |
1 |
0 |
0 |
0.116 |
6 |
16 |
|
C |
30 |
10 |
7875 |
◊ |
A |
x,y,z |
1_555 |
30 |
10 |
7734 |
292.1 |
-1.7 |
0.594 |
4 |
0 |
0 |
0.026 |
7 |
17 |
|
D |
39 |
13 |
8001 |
◊ |
E |
x-y,-y,-z-1/3 |
5_554 |
30 |
6 |
7633 |
279.4 |
-4.2 |
0.388 |
1 |
0 |
0 |
0.002 |
8 |
18 |
|
F |
32 |
10 |
8067 |
◊ |
A |
x,y,z |
1_555 |
26 |
6 |
7734 |
238.4 |
-3.4 |
0.431 |
2 |
1 |
0 |
0.002 |
9 |
19 |
|
F |
32 |
9 |
8067 |
◊ |
D |
x,y,z |
1_555 |
21 |
7 |
8001 |
224.5 |
-0.7 |
0.718 |
2 |
0 |
0 |
0.000 |
10 |
20 |
|
B |
23 |
9 |
8077 |
◊ |
C |
x-y,-y,-z+2/3 |
5_555 |
17 |
4 |
7875 |
163.6 |
-1.9 |
0.505 |
1 |
0 |
0 |
0.000 |
11 |
21 |
|
E |
16 |
5 |
7633 |
◊ |
C |
y,x-1,-z |
4_545 |
19 |
6 |
7875 |
158.5 |
-1.1 |
0.580 |
1 |
1 |
0 |
0.021 |
22 |
|
C |
15 |
5 |
7875 |
◊ |
A |
-x+1,-x+y,-z+1/3 |
6_655 |
19 |
6 |
7734 |
151.3 |
-1.4 |
0.535 |
0 |
0 |
0 |
0.021 |
23 |
|
A |
14 |
5 |
7734 |
◊ |
E |
-y,x-y,z+1/3 |
2_555 |
19 |
6 |
7633 |
145.7 |
-1.2 |
0.549 |
0 |
0 |
0 |
0.021 |
Average: |
151.8 |
-1.2 |
0.555 |
0 |
0 |
0 |
0.021 |
12 |
24 |
|
E |
16 |
7 |
7633 |
◊ |
C |
x,y,z |
1_555 |
20 |
6 |
7875 |
154.6 |
-0.6 |
0.604 |
3 |
0 |
0 |
0.000 |
13 |
25 |
|
A |
13 |
4 |
7734 |
◊ |
A |
x-y,-y,-z+2/3 |
5_555 |
13 |
4 |
7734 |
121.2 |
1.5 |
0.863 |
3 |
0 |
0 |
0.000 |
14 |
26 |
|
[CMO]E:202 |
2 |
1 |
136 |
f |
E |
x,y,z |
1_555 |
11 |
6 |
7633 |
65.6 |
-1.0 |
0.652 |
0 |
0 |
0 |
0.017 |
15 |
27 |
|
[CMO]A:202 |
2 |
1 |
136 |
f |
A |
x,y,z |
1_555 |
12 |
6 |
7734 |
65.1 |
-0.8 |
0.684 |
1 |
0 |
0 |
0.021 |
16 |
28 |
|
[CMO]C:202 |
2 |
1 |
136 |
f |
C |
x,y,z |
1_555 |
12 |
6 |
7875 |
64.9 |
-0.9 |
0.661 |
1 |
0 |
0 |
0.023 |
17 |
29 |
|
[CMO]B:202 |
2 |
1 |
136 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
8077 |
63.7 |
-0.4 |
0.760 |
1 |
0 |
0 |
0.014 |
18 |
30 |
|
[CMO]F:202 |
2 |
1 |
137 |
f |
F |
x,y,z |
1_555 |
12 |
7 |
8067 |
63.6 |
-0.3 |
0.772 |
1 |
0 |
0 |
0.013 |
19 |
31 |
|
F |
8 |
3 |
8067 |
◊ |
C |
x,y,z |
1_555 |
8 |
4 |
7875 |
62.6 |
-1.0 |
0.467 |
0 |
0 |
0 |
0.000 |
20 |
32 |
|
[CMO]D:202 |
2 |
1 |
136 |
f |
D |
x,y,z |
1_555 |
12 |
7 |
8001 |
62.6 |
-0.3 |
0.771 |
1 |
0 |
0 |
0.012 |
21 |
33 |
|
[CMO]E:202 |
2 |
1 |
136 |
cf |
[HEM]E:201 |
x,y,z |
1_555 |
17 |
1 |
826 |
45.6 |
-1.7 |
0.500 |
0 |
0 |
0 |
0.031 |
22 |
34 |
|
[CMO]A:202 |
2 |
1 |
136 |
cf |
[HEM]A:201 |
x,y,z |
1_555 |
17 |
1 |
839 |
45.0 |
-1.8 |
0.500 |
0 |
0 |
0 |
0.031 |
23 |
35 |
|
[CMO]D:202 |
2 |
1 |
136 |
cf |
[HEM]D:201 |
x,y,z |
1_555 |
16 |
1 |
821 |
44.7 |
-1.7 |
0.500 |
0 |
0 |
0 |
0.029 |
24 |
36 |
|
[CMO]C:202 |
2 |
1 |
136 |
cf |
[HEM]C:201 |
x,y,z |
1_555 |
16 |
1 |
837 |
44.6 |
-1.8 |
0.500 |
0 |
0 |
0 |
0.030 |
25 |
37 |
|
[CMO]F:202 |
2 |
1 |
137 |
cf |
[HEM]F:201 |
x,y,z |
1_555 |
15 |
1 |
816 |
44.6 |
-1.9 |
0.500 |
0 |
0 |
0 |
0.033 |
26 |
38 |
|
[CMO]B:202 |
2 |
1 |
136 |
cf |
[HEM]B:201 |
x,y,z |
1_555 |
16 |
1 |
832 |
43.8 |
-1.8 |
0.500 |
0 |
0 |
0 |
0.030 |
27 |
39 |
|
B |
2 |
1 |
8077 |
◊ |
D |
-y+1,x-y,z+1/3 |
2_655 |
2 |
1 |
8001 |
25.8 |
0.8 |
0.591 |
0 |
0 |
0 |
0.000 |
28 |
40 |
|
D |
1 |
1 |
8001 |
◊ |
E |
x,y,z |
1_555 |
1 |
1 |
7633 |
10.0 |
-0.1 |
0.449 |
0 |
0 |
0 |
0.000 |
29 |
41 |
|
F |
2 |
2 |
8067 |
◊ |
F |
x-y,-y,-z-1/3 |
5_554 |
2 |
2 |
8067 |
8.4 |
-0.0 |
0.644 |
0 |
0 |
0 |
0.000 |
30 |
42 |
|
B |
1 |
1 |
8077 |
◊ |
[HEM]D:201 |
-y+1,x-y,z+1/3 |
2_655 |
1 |
1 |
821 |
3.7 |
-0.3 |
0.467 |
0 |
0 |
0 |
0.000 |
|