## |
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 |
263 |
71 |
20317 |
◊ |
A |
x,y,z |
1_555 |
263 |
70 |
20396 |
2614.9 |
-36.9 |
0.008 |
35 |
9 |
0 |
0.508 |
2 |
2 |
|
A |
69 |
19 |
20396 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
72 |
19 |
20317 |
648.9 |
-1.0 |
0.691 |
16 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]B:750 |
43 |
1 |
815 |
f |
B |
x,y,z |
1_555 |
77 |
24 |
20317 |
514.0 |
-17.1 |
0.316 |
0 |
0 |
0 |
0.325 |
4 |
|
[HEM]A:750 |
42 |
1 |
805 |
f |
A |
x,y,z |
1_555 |
76 |
23 |
20396 |
509.0 |
-17.3 |
0.259 |
0 |
0 |
0 |
0.325 |
Average: |
511.5 |
-17.2 |
0.287 |
0 |
0 |
0 |
0.325 |
4 |
5 |
|
B |
51 |
15 |
20317 |
x |
B |
x-1,y,z |
1_455 |
55 |
15 |
20317 |
475.0 |
1.3 |
0.759 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
[JI5]A:800 |
25 |
1 |
653 |
f |
A |
x,y,z |
1_555 |
47 |
21 |
20396 |
351.5 |
2.5 |
0.482 |
2 |
0 |
0 |
0.000 |
7 |
|
[JI5]B:800 |
26 |
1 |
649 |
f |
B |
x,y,z |
1_555 |
45 |
21 |
20317 |
347.3 |
2.0 |
0.453 |
1 |
0 |
0 |
0.000 |
Average: |
349.4 |
2.3 |
0.467 |
2 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
42 |
10 |
20317 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
33 |
8 |
20396 |
320.3 |
-1.4 |
0.538 |
4 |
2 |
0 |
0.000 |
7 |
9 |
|
A |
30 |
13 |
20396 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
29 |
9 |
20317 |
222.2 |
1.3 |
0.777 |
1 |
3 |
0 |
0.000 |
8 |
10 |
|
[H4B]B:761 |
17 |
1 |
394 |
f |
B |
x,y,z |
1_555 |
29 |
9 |
20317 |
183.0 |
2.3 |
0.506 |
2 |
0 |
0 |
0.000 |
11 |
|
[H4B]A:760 |
17 |
1 |
398 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
20396 |
179.3 |
2.3 |
0.482 |
2 |
0 |
0 |
0.000 |
Average: |
181.2 |
2.3 |
0.494 |
2 |
0 |
0 |
0.000 |
9 |
12 |
|
[JI5]B:800 |
18 |
1 |
649 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
34 |
1 |
815 |
174.2 |
-4.1 |
0.567 |
5 |
0 |
0 |
0.103 |
13 |
|
[JI5]A:800 |
18 |
1 |
653 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
34 |
1 |
805 |
171.6 |
-3.7 |
0.532 |
2 |
0 |
0 |
0.103 |
Average: |
172.9 |
-3.9 |
0.550 |
4 |
0 |
0 |
0.103 |
10 |
14 |
|
[H4B]B:761 |
13 |
1 |
394 |
◊ |
A |
x,y,z |
1_555 |
20 |
6 |
20396 |
117.7 |
-0.2 |
0.260 |
1 |
0 |
0 |
0.011 |
15 |
|
[H4B]A:760 |
13 |
1 |
398 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
20317 |
113.9 |
-0.1 |
0.268 |
1 |
0 |
0 |
0.011 |
Average: |
115.8 |
-0.1 |
0.264 |
1 |
0 |
0 |
0.011 |
11 |
16 |
|
[ACT]B:861 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
21 |
9 |
20317 |
116.4 |
-1.4 |
0.502 |
1 |
0 |
0 |
0.017 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
183 |
f |
A |
x,y,z |
1_555 |
19 |
9 |
20396 |
113.7 |
-1.5 |
0.465 |
1 |
0 |
0 |
0.018 |
13 |
18 |
|
[H4B]A:760 |
4 |
1 |
398 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
6 |
1 |
805 |
41.4 |
-0.8 |
0.549 |
1 |
0 |
0 |
0.032 |
19 |
|
[H4B]B:761 |
4 |
1 |
394 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
815 |
40.0 |
-1.3 |
0.454 |
2 |
0 |
0 |
0.032 |
Average: |
40.7 |
-1.0 |
0.501 |
2 |
0 |
0 |
0.032 |
14 |
20 |
|
[ACT]A:860 |
2 |
1 |
183 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
805 |
37.7 |
-1.2 |
0.690 |
0 |
0 |
0 |
0.011 |
15 |
21 |
|
[JI5]A:800 |
3 |
1 |
653 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
3 |
1 |
398 |
35.2 |
0.4 |
0.302 |
1 |
0 |
0 |
0.001 |
22 |
|
[JI5]B:800 |
3 |
1 |
649 |
f |
[H4B]B:761 |
x,y,z |
1_555 |
3 |
1 |
394 |
30.5 |
0.3 |
0.312 |
1 |
0 |
0 |
0.001 |
Average: |
32.9 |
0.4 |
0.307 |
1 |
0 |
0 |
0.001 |
16 |
23 |
|
[ACT]B:861 |
1 |
1 |
183 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
815 |
35.2 |
-1.1 |
0.490 |
0 |
0 |
0 |
0.011 |
17 |
24 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20396 |
34.2 |
-20.7 |
0.000 |
0 |
0 |
0 |
0.277 |
25 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20317 |
33.4 |
-19.8 |
0.000 |
0 |
0 |
0 |
0.277 |
Average: |
33.8 |
-20.2 |
0.000 |
0 |
0 |
0 |
0.277 |
18 |
26 |
|
[JI5]B:800 |
1 |
1 |
649 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
20396 |
34.1 |
-1.1 |
0.154 |
0 |
0 |
0 |
0.020 |
27 |
|
[JI5]A:800 |
2 |
1 |
653 |
◊ |
B |
x,y,z |
1_555 |
3 |
1 |
20317 |
30.4 |
-1.0 |
0.189 |
0 |
0 |
0 |
0.020 |
Average: |
32.2 |
-1.0 |
0.172 |
0 |
0 |
0 |
0.020 |
19 |
28 |
|
B |
1 |
1 |
20317 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
1 |
1 |
20317 |
14.8 |
0.8 |
0.935 |
0 |
0 |
0 |
0.000 |
20 |
29 |
|
A |
2 |
1 |
20396 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
20396 |
13.2 |
-0.4 |
0.241 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
A |
1 |
1 |
20396 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
20317 |
12.1 |
-0.0 |
0.613 |
0 |
0 |
0 |
0.000 |
|