## |
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 |
69 |
20345 |
◊ |
A |
x,y,z |
1_555 |
266 |
71 |
20265 |
2632.6 |
-38.2 |
0.008 |
39 |
8 |
0 |
0.566 |
2 |
2 |
|
A |
70 |
20 |
20265 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
71 |
20 |
20345 |
666.8 |
-1.6 |
0.680 |
9 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]A:750 |
43 |
1 |
817 |
f |
A |
x,y,z |
1_555 |
76 |
23 |
20265 |
510.6 |
-17.5 |
0.326 |
1 |
0 |
0 |
0.354 |
4 |
|
[HEM]B:750 |
43 |
1 |
813 |
f |
B |
x,y,z |
1_555 |
78 |
24 |
20345 |
510.0 |
-17.6 |
0.334 |
0 |
0 |
0 |
0.354 |
Average: |
510.3 |
-17.5 |
0.330 |
1 |
0 |
0 |
0.354 |
4 |
5 |
|
B |
49 |
14 |
20345 |
x |
B |
x-1,y,z |
1_455 |
54 |
15 |
20345 |
459.3 |
-1.3 |
0.632 |
2 |
0 |
0 |
0.000 |
5 |
6 |
|
[JSS]A:800 |
25 |
1 |
652 |
f |
A |
x,y,z |
1_555 |
54 |
21 |
20265 |
343.6 |
5.1 |
0.331 |
4 |
0 |
0 |
0.000 |
7 |
|
[JSS]B:800 |
25 |
1 |
652 |
f |
B |
x,y,z |
1_555 |
52 |
19 |
20345 |
341.3 |
5.2 |
0.353 |
4 |
0 |
0 |
0.000 |
Average: |
342.5 |
5.2 |
0.342 |
4 |
0 |
0 |
0.000 |
6 |
8 |
|
B |
38 |
11 |
20345 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
3_645 |
29 |
8 |
20265 |
288.0 |
-1.6 |
0.546 |
3 |
2 |
0 |
0.000 |
7 |
9 |
|
[H4B]A:760 |
17 |
1 |
402 |
f |
A |
x,y,z |
1_555 |
27 |
9 |
20265 |
196.3 |
2.1 |
0.445 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]B:760 |
17 |
1 |
398 |
f |
B |
x,y,z |
1_555 |
27 |
8 |
20345 |
191.7 |
1.9 |
0.436 |
2 |
0 |
0 |
0.000 |
Average: |
194.0 |
2.0 |
0.440 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
[JSS]B:800 |
18 |
1 |
652 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
32 |
1 |
813 |
165.8 |
-1.0 |
0.390 |
2 |
0 |
0 |
0.040 |
12 |
|
[JSS]A:800 |
18 |
1 |
652 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
34 |
1 |
817 |
164.5 |
-1.2 |
0.363 |
2 |
0 |
0 |
0.040 |
Average: |
165.1 |
-1.1 |
0.376 |
2 |
0 |
0 |
0.040 |
9 |
13 |
|
A |
15 |
7 |
20265 |
◊ |
B |
-x,y-1/2,-z+1/2 |
3_545 |
19 |
4 |
20345 |
137.0 |
0.5 |
0.740 |
1 |
1 |
0 |
0.000 |
10 |
14 |
|
[H4B]A:760 |
14 |
1 |
402 |
◊ |
B |
x,y,z |
1_555 |
22 |
6 |
20345 |
121.3 |
-0.1 |
0.244 |
1 |
0 |
0 |
0.012 |
15 |
|
[H4B]B:760 |
14 |
1 |
398 |
◊ |
A |
x,y,z |
1_555 |
23 |
6 |
20265 |
120.5 |
-0.2 |
0.251 |
1 |
0 |
0 |
0.012 |
Average: |
120.9 |
-0.1 |
0.247 |
1 |
0 |
0 |
0.012 |
11 |
16 |
|
[ACT]B:860 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
18 |
9 |
20345 |
114.7 |
-1.3 |
0.501 |
1 |
0 |
0 |
0.018 |
12 |
17 |
|
[ACT]A:860 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
18 |
9 |
20265 |
113.5 |
-1.3 |
0.488 |
1 |
0 |
0 |
0.018 |
13 |
18 |
|
[H4B]B:760 |
5 |
1 |
398 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
813 |
43.0 |
-1.2 |
0.421 |
2 |
0 |
0 |
0.042 |
19 |
|
[H4B]A:760 |
5 |
1 |
402 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
817 |
42.0 |
-1.2 |
0.399 |
2 |
0 |
0 |
0.042 |
Average: |
42.5 |
-1.2 |
0.410 |
2 |
0 |
0 |
0.042 |
14 |
20 |
|
[JSS]A:800 |
2 |
1 |
652 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
20345 |
37.8 |
-1.2 |
0.128 |
0 |
0 |
0 |
0.024 |
21 |
|
[JSS]B:800 |
3 |
1 |
652 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
20265 |
36.4 |
-1.2 |
0.144 |
0 |
0 |
0 |
0.024 |
Average: |
37.1 |
-1.2 |
0.136 |
0 |
0 |
0 |
0.024 |
15 |
22 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20265 |
34.9 |
-20.6 |
0.000 |
0 |
0 |
0 |
0.288 |
23 |
|
[ZN]A:900 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20345 |
34.3 |
-20.0 |
0.000 |
0 |
0 |
0 |
0.288 |
Average: |
34.6 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.288 |
16 |
24 |
|
[ACT]A:860 |
3 |
1 |
182 |
f |
[HEM]A:750 |
x,y,z |
1_555 |
5 |
1 |
817 |
33.2 |
-1.0 |
0.755 |
0 |
0 |
0 |
0.010 |
17 |
25 |
|
[ACT]B:860 |
3 |
1 |
183 |
f |
[HEM]B:750 |
x,y,z |
1_555 |
5 |
1 |
813 |
32.3 |
-1.0 |
0.755 |
0 |
0 |
0 |
0.010 |
18 |
26 |
|
A |
3 |
2 |
20265 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
20345 |
25.1 |
0.4 |
0.793 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
B |
1 |
1 |
20345 |
x |
B |
x-1/2,-y+1/2,-z+1 |
4_456 |
3 |
2 |
20345 |
22.2 |
1.2 |
0.923 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
[JSS]B:800 |
1 |
1 |
652 |
f |
[H4B]B:760 |
x,y,z |
1_555 |
3 |
1 |
398 |
12.6 |
0.3 |
0.374 |
0 |
0 |
0 |
0.000 |
29 |
|
[JSS]A:800 |
1 |
1 |
652 |
f |
[H4B]A:760 |
x,y,z |
1_555 |
3 |
1 |
402 |
9.2 |
0.1 |
0.363 |
0 |
0 |
0 |
0.000 |
Average: |
10.9 |
0.2 |
0.369 |
0 |
0 |
0 |
0.000 |
21 |
30 |
|
A |
1 |
1 |
20265 |
x |
A |
x-1/2,-y+1/2,-z |
4_455 |
1 |
1 |
20265 |
3.6 |
-0.1 |
0.371 |
0 |
0 |
0 |
0.000 |
|