## |
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 |
266 |
70 |
19972 |
◊ |
A |
x,y,z |
1_555 |
271 |
70 |
20137 |
2633.9 |
-37.7 |
0.008 |
42 |
9 |
0 |
0.376 |
2 |
2 |
|
A |
71 |
19 |
20137 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
69 |
18 |
19972 |
654.4 |
-0.5 |
0.735 |
17 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]B:801 |
42 |
1 |
825 |
f |
B |
x,y,z |
1_555 |
79 |
25 |
19972 |
515.2 |
-18.5 |
0.278 |
1 |
0 |
0 |
0.243 |
4 |
|
[HEM]A:801 |
42 |
1 |
825 |
f |
A |
x,y,z |
1_555 |
75 |
24 |
20137 |
512.7 |
-18.0 |
0.283 |
1 |
0 |
0 |
0.243 |
Average: |
514.0 |
-18.2 |
0.280 |
1 |
0 |
0 |
0.243 |
4 |
5 |
|
B |
50 |
14 |
19972 |
x |
B |
x-1,y,z |
1_455 |
51 |
15 |
19972 |
460.1 |
1.1 |
0.779 |
3 |
1 |
0 |
0.000 |
5 |
6 |
|
[BY7]A:803 |
26 |
1 |
639 |
f |
A |
x,y,z |
1_555 |
58 |
23 |
20137 |
352.0 |
-1.7 |
0.604 |
6 |
0 |
0 |
0.060 |
7 |
|
[BY7]B:803 |
26 |
1 |
637 |
f |
B |
x,y,z |
1_555 |
56 |
22 |
19972 |
336.2 |
-2.1 |
0.553 |
6 |
0 |
0 |
0.060 |
Average: |
344.1 |
-1.9 |
0.579 |
6 |
0 |
0 |
0.060 |
6 |
8 |
|
B |
40 |
13 |
19972 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
33 |
9 |
20137 |
318.1 |
-1.3 |
0.578 |
2 |
2 |
0 |
0.000 |
7 |
9 |
|
[H4B]B:802 |
17 |
1 |
396 |
f |
B |
x,y,z |
1_555 |
30 |
9 |
19972 |
191.1 |
1.7 |
0.469 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]A:802 |
17 |
1 |
394 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
20137 |
189.2 |
1.6 |
0.455 |
2 |
0 |
0 |
0.000 |
Average: |
190.2 |
1.7 |
0.462 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
[MTL]B:805 |
12 |
1 |
327 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
19972 |
177.7 |
1.4 |
0.430 |
10 |
0 |
0 |
0.020 |
9 |
12 |
|
A |
28 |
13 |
20137 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
25 |
8 |
19972 |
177.2 |
1.3 |
0.792 |
2 |
4 |
0 |
0.000 |
10 |
13 |
|
[BY7]B:803 |
21 |
1 |
637 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
35 |
1 |
825 |
166.6 |
-6.1 |
0.695 |
1 |
0 |
0 |
0.084 |
14 |
|
[BY7]A:803 |
22 |
1 |
639 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
33 |
1 |
825 |
162.4 |
-6.0 |
0.701 |
1 |
0 |
0 |
0.084 |
Average: |
164.5 |
-6.0 |
0.698 |
1 |
0 |
0 |
0.084 |
11 |
15 |
|
[H4B]B:802 |
13 |
1 |
396 |
◊ |
A |
x,y,z |
1_555 |
22 |
6 |
20137 |
117.0 |
-0.1 |
0.277 |
1 |
0 |
0 |
0.007 |
16 |
|
[H4B]A:802 |
13 |
1 |
394 |
◊ |
B |
x,y,z |
1_555 |
21 |
6 |
19972 |
116.7 |
-0.1 |
0.281 |
1 |
0 |
0 |
0.007 |
Average: |
116.8 |
-0.1 |
0.279 |
1 |
0 |
0 |
0.007 |
12 |
17 |
|
[ACT]B:804 |
4 |
1 |
182 |
f |
B |
x,y,z |
1_555 |
18 |
8 |
19972 |
113.9 |
-1.4 |
0.489 |
1 |
0 |
0 |
0.012 |
13 |
18 |
|
[ACT]A:804 |
4 |
1 |
181 |
f |
A |
x,y,z |
1_555 |
18 |
8 |
20137 |
110.8 |
-1.3 |
0.488 |
1 |
0 |
0 |
0.011 |
14 |
19 |
|
[CL]B:806 |
1 |
1 |
125 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
19972 |
61.0 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.113 |
20 |
|
[CL]A:805 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
15 |
8 |
20137 |
59.0 |
-8.6 |
0.000 |
0 |
0 |
0 |
0.113 |
Average: |
60.0 |
-8.7 |
0.000 |
0 |
0 |
0 |
0.113 |
15 |
21 |
|
[H4B]A:802 |
4 |
1 |
394 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
5 |
1 |
825 |
43.4 |
-1.2 |
0.456 |
2 |
0 |
0 |
0.027 |
22 |
|
[H4B]B:802 |
5 |
1 |
396 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
825 |
42.6 |
-1.2 |
0.417 |
2 |
0 |
0 |
0.027 |
Average: |
43.0 |
-1.2 |
0.436 |
2 |
0 |
0 |
0.027 |
16 |
23 |
|
[ACT]A:804 |
3 |
1 |
181 |
f |
[HEM]A:801 |
x,y,z |
1_555 |
5 |
1 |
825 |
36.5 |
-1.1 |
0.751 |
0 |
0 |
0 |
0.007 |
17 |
24 |
|
[ZN]A:806 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20137 |
34.5 |
-20.5 |
0.000 |
0 |
0 |
0 |
0.209 |
25 |
|
[ZN]A:806 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
19972 |
34.3 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.209 |
Average: |
34.4 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.209 |
18 |
26 |
|
[ACT]B:804 |
3 |
1 |
182 |
f |
[HEM]B:801 |
x,y,z |
1_555 |
5 |
1 |
825 |
33.5 |
-1.1 |
0.757 |
0 |
0 |
0 |
0.007 |
19 |
27 |
|
[MTL]B:805 |
2 |
1 |
327 |
f |
[BY7]B:803 |
x,y,z |
1_555 |
3 |
1 |
637 |
33.1 |
0.9 |
0.651 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[CL]A:805 |
1 |
1 |
125 |
f |
[BY7]A:803 |
x,y,z |
1_555 |
8 |
1 |
639 |
32.5 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.047 |
29 |
|
[CL]B:806 |
1 |
1 |
125 |
f |
[BY7]B:803 |
x,y,z |
1_555 |
8 |
1 |
637 |
30.1 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.047 |
Average: |
31.3 |
-3.6 |
0.000 |
0 |
0 |
0 |
0.047 |
21 |
30 |
|
[BY7]B:803 |
6 |
1 |
637 |
f |
[H4B]B:802 |
x,y,z |
1_555 |
4 |
1 |
396 |
25.3 |
0.0 |
0.298 |
0 |
0 |
0 |
0.000 |
31 |
|
[BY7]A:803 |
7 |
1 |
639 |
f |
[H4B]A:802 |
x,y,z |
1_555 |
4 |
1 |
394 |
24.2 |
0.0 |
0.328 |
0 |
0 |
0 |
0.000 |
Average: |
24.7 |
0.0 |
0.313 |
0 |
0 |
0 |
0.000 |
22 |
32 |
|
B |
1 |
1 |
19972 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
19972 |
6.4 |
0.0 |
0.492 |
0 |
0 |
0 |
0.000 |
23 |
33 |
|
[BY7]A:803 |
1 |
1 |
639 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
19972 |
5.6 |
-0.2 |
0.528 |
0 |
0 |
0 |
0.001 |
24 |
34 |
|
A |
1 |
1 |
20137 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
20137 |
4.6 |
-0.1 |
0.341 |
0 |
0 |
0 |
0.000 |
25 |
35 |
|
A |
1 |
1 |
20137 |
◊ |
B |
x-1,y,z |
1_455 |
1 |
1 |
19972 |
4.1 |
0.1 |
0.778 |
0 |
0 |
0 |
0.000 |
|