## |
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 |
268 |
69 |
20217 |
◊ |
A |
x,y,z |
1_555 |
262 |
68 |
20042 |
2626.1 |
-38.0 |
0.007 |
36 |
9 |
0 |
0.441 |
2 |
2 |
|
A |
65 |
19 |
20042 |
◊ |
B |
-x+1/2,-y,z-1/2 |
2_554 |
68 |
18 |
20217 |
653.9 |
-0.9 |
0.708 |
14 |
0 |
0 |
0.000 |
3 |
3 |
|
[HEM]B:1719 |
43 |
1 |
819 |
f |
B |
x,y,z |
1_555 |
75 |
22 |
20217 |
501.6 |
-17.0 |
0.296 |
1 |
0 |
0 |
0.273 |
4 |
|
[HEM]A:1717 |
43 |
1 |
817 |
f |
A |
x,y,z |
1_555 |
73 |
23 |
20042 |
499.4 |
-16.5 |
0.308 |
1 |
0 |
0 |
0.273 |
Average: |
500.5 |
-16.7 |
0.302 |
1 |
0 |
0 |
0.273 |
4 |
5 |
|
B |
50 |
15 |
20217 |
x |
B |
x-1,y,z |
1_455 |
52 |
15 |
20217 |
456.5 |
-0.1 |
0.647 |
3 |
0 |
0 |
0.000 |
5 |
6 |
|
[7S7]A:1719 |
28 |
1 |
656 |
f |
A |
x,y,z |
1_555 |
59 |
21 |
20042 |
374.9 |
-4.6 |
0.500 |
4 |
0 |
0 |
0.100 |
7 |
|
[7S7]B:1721 |
28 |
1 |
656 |
f |
B |
x,y,z |
1_555 |
57 |
21 |
20217 |
361.1 |
-4.4 |
0.507 |
4 |
0 |
0 |
0.100 |
Average: |
368.0 |
-4.5 |
0.503 |
4 |
0 |
0 |
0.100 |
6 |
8 |
|
B |
42 |
11 |
20217 |
◊ |
A |
-x+1,y-1/2,-z+1/2 |
4_645 |
30 |
8 |
20042 |
307.9 |
-1.7 |
0.542 |
3 |
2 |
0 |
0.000 |
7 |
9 |
|
[H4B]B:1720 |
17 |
1 |
400 |
f |
B |
x,y,z |
1_555 |
28 |
9 |
20217 |
199.3 |
2.0 |
0.461 |
2 |
0 |
0 |
0.000 |
10 |
|
[H4B]A:1718 |
17 |
1 |
397 |
f |
A |
x,y,z |
1_555 |
28 |
9 |
20042 |
197.7 |
2.0 |
0.451 |
2 |
0 |
0 |
0.000 |
Average: |
198.5 |
2.0 |
0.456 |
2 |
0 |
0 |
0.000 |
8 |
11 |
|
A |
25 |
11 |
20042 |
◊ |
B |
-x,y-1/2,-z+1/2 |
4_545 |
23 |
8 |
20217 |
191.1 |
0.8 |
0.731 |
1 |
1 |
0 |
0.000 |
9 |
12 |
|
[7S7]B:1721 |
19 |
1 |
656 |
f |
[HEM]B:1719 |
x,y,z |
1_555 |
32 |
1 |
819 |
183.4 |
-5.5 |
0.949 |
1 |
0 |
0 |
0.098 |
13 |
|
[7S7]A:1719 |
19 |
1 |
656 |
f |
[HEM]A:1717 |
x,y,z |
1_555 |
33 |
1 |
817 |
180.1 |
-5.5 |
0.953 |
2 |
0 |
0 |
0.098 |
Average: |
181.7 |
-5.5 |
0.951 |
2 |
0 |
0 |
0.098 |
10 |
14 |
|
[H4B]B:1720 |
13 |
1 |
400 |
◊ |
A |
x,y,z |
1_555 |
22 |
6 |
20042 |
122.1 |
-0.1 |
0.273 |
1 |
0 |
0 |
0.009 |
15 |
|
[H4B]A:1718 |
13 |
1 |
397 |
◊ |
B |
x,y,z |
1_555 |
23 |
6 |
20217 |
117.7 |
-0.1 |
0.270 |
1 |
0 |
0 |
0.009 |
Average: |
119.9 |
-0.1 |
0.272 |
1 |
0 |
0 |
0.009 |
11 |
16 |
|
[ACT]B:1722 |
4 |
1 |
183 |
f |
B |
x,y,z |
1_555 |
19 |
9 |
20217 |
113.1 |
-1.3 |
0.474 |
1 |
0 |
0 |
0.014 |
12 |
17 |
|
[ACT]A:1720 |
4 |
1 |
182 |
f |
A |
x,y,z |
1_555 |
19 |
8 |
20042 |
112.0 |
-1.3 |
0.493 |
1 |
0 |
0 |
0.014 |
13 |
18 |
|
[H4B]B:1720 |
4 |
1 |
400 |
f |
[HEM]B:1719 |
x,y,z |
1_555 |
5 |
1 |
819 |
41.5 |
-1.2 |
0.451 |
2 |
0 |
0 |
0.032 |
19 |
|
[H4B]A:1718 |
4 |
1 |
397 |
f |
[HEM]A:1717 |
x,y,z |
1_555 |
5 |
1 |
817 |
41.3 |
-1.1 |
0.473 |
2 |
0 |
0 |
0.032 |
Average: |
41.4 |
-1.1 |
0.462 |
2 |
0 |
0 |
0.032 |
14 |
20 |
|
[ACT]A:1720 |
3 |
1 |
182 |
f |
[HEM]A:1717 |
x,y,z |
1_555 |
5 |
1 |
817 |
36.3 |
-1.2 |
0.753 |
0 |
0 |
0 |
0.009 |
15 |
21 |
|
[ZN]A:1721 |
1 |
1 |
98 |
◊ |
A |
x,y,z |
1_555 |
5 |
3 |
20042 |
34.2 |
-20.4 |
0.000 |
0 |
0 |
0 |
0.244 |
22 |
|
[ZN]A:1721 |
1 |
1 |
98 |
◊ |
B |
x,y,z |
1_555 |
5 |
3 |
20217 |
34.1 |
-20.1 |
0.000 |
0 |
0 |
0 |
0.244 |
Average: |
34.2 |
-20.3 |
0.000 |
0 |
0 |
0 |
0.244 |
16 |
23 |
|
[ACT]B:1722 |
3 |
1 |
183 |
f |
[HEM]B:1719 |
x,y,z |
1_555 |
5 |
1 |
819 |
34.1 |
-1.0 |
0.659 |
0 |
0 |
0 |
0.008 |
17 |
24 |
|
[7S7]B:1721 |
1 |
1 |
656 |
◊ |
A |
x,y,z |
1_555 |
6 |
1 |
20042 |
31.0 |
-1.0 |
0.192 |
0 |
0 |
0 |
0.015 |
25 |
|
[7S7]A:1719 |
1 |
1 |
656 |
◊ |
B |
x,y,z |
1_555 |
6 |
1 |
20217 |
29.7 |
-1.0 |
0.196 |
0 |
0 |
0 |
0.015 |
Average: |
30.3 |
-1.0 |
0.194 |
0 |
0 |
0 |
0.015 |
18 |
26 |
|
B |
2 |
1 |
20217 |
x |
B |
x-1/2,-y+1/2,-z+1 |
3_456 |
3 |
2 |
20217 |
11.2 |
0.6 |
0.840 |
0 |
0 |
0 |
0.000 |
19 |
27 |
|
A |
4 |
2 |
20042 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
1 |
20217 |
8.6 |
0.2 |
0.733 |
0 |
0 |
0 |
0.000 |
20 |
28 |
|
A |
2 |
1 |
20042 |
x |
A |
x-1/2,-y+1/2,-z |
3_455 |
1 |
1 |
20042 |
7.8 |
-0.2 |
0.329 |
0 |
0 |
0 |
0.000 |
21 |
29 |
|
[7S7]B:1721 |
3 |
1 |
656 |
f |
[H4B]B:1720 |
x,y,z |
1_555 |
1 |
1 |
400 |
5.0 |
-0.2 |
0.291 |
0 |
0 |
0 |
0.003 |
30 |
|
[7S7]A:1719 |
3 |
1 |
656 |
f |
[H4B]A:1718 |
x,y,z |
1_555 |
1 |
1 |
397 |
4.3 |
-0.2 |
0.290 |
0 |
0 |
0 |
0.003 |
Average: |
4.7 |
-0.2 |
0.290 |
0 |
0 |
0 |
0.003 |
22 |
31 |
|
A |
1 |
1 |
20042 |
x |
A |
-x,y-1/2,-z+1/2 |
4_545 |
1 |
1 |
20042 |
2.5 |
0.2 |
0.816 |
0 |
0 |
0 |
0.000 |
|