| ## |
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 |
89 |
23 |
17118 |
x |
B |
-x,y-1/2,-z |
2_545 |
76 |
23 |
17118 |
741.8 |
-3.3 |
0.444 |
4 |
9 |
0 |
0.000 |
2 |
|
A |
76 |
23 |
16849 |
x |
A |
-x+1,y-1/2,-z+1 |
2_646 |
69 |
23 |
16849 |
640.8 |
-4.3 |
0.339 |
3 |
6 |
0 |
0.000 |
| Average: |
691.3 |
-3.8 |
0.391 |
4 |
8 |
0 |
0.000 |
| 2 |
3 |
|
[HEM]B:1415 |
43 |
1 |
834 |
f |
B |
x,y,z |
1_555 |
81 |
33 |
17118 |
573.5 |
-22.7 |
0.199 |
5 |
0 |
0 |
0.141 |
4 |
|
[HEM]A:1415 |
41 |
1 |
831 |
f |
A |
x,y,z |
1_555 |
82 |
32 |
16849 |
571.1 |
-22.7 |
0.195 |
5 |
0 |
0 |
0.141 |
| Average: |
572.3 |
-22.7 |
0.197 |
5 |
0 |
0 |
0.141 |
| 3 |
5 |
|
A |
54 |
16 |
16849 |
◊ |
B |
-x+1,y-1/2,-z |
2_645 |
48 |
11 |
17118 |
472.6 |
-3.4 |
0.354 |
7 |
0 |
0 |
0.018 |
| 4 |
6 |
|
B |
36 |
12 |
17118 |
◊ |
A |
x,y,z |
1_555 |
29 |
7 |
16849 |
286.6 |
1.9 |
0.818 |
5 |
8 |
0 |
0.000 |
| 5 |
7 |
|
A |
35 |
15 |
16849 |
◊ |
B |
-x,y-1/2,-z |
2_545 |
30 |
15 |
17118 |
265.0 |
-0.0 |
0.612 |
4 |
4 |
0 |
0.000 |
| 6 |
8 |
|
B |
22 |
8 |
17118 |
x |
B |
-x+1,y-1/2,-z |
2_645 |
25 |
7 |
17118 |
214.3 |
-1.6 |
0.346 |
2 |
0 |
0 |
0.000 |
| 7 |
9 |
|
[CAM]A:1416 |
8 |
1 |
306 |
f |
A |
x,y,z |
1_555 |
26 |
15 |
16849 |
172.6 |
4.9 |
0.241 |
1 |
0 |
0 |
0.000 |
10 |
|
[CAM]B:1416 |
8 |
1 |
305 |
f |
B |
x,y,z |
1_555 |
24 |
16 |
17118 |
170.5 |
4.8 |
0.249 |
1 |
0 |
0 |
0.000 |
| Average: |
171.5 |
4.9 |
0.245 |
1 |
0 |
0 |
0.000 |
| 8 |
11 |
|
A |
17 |
5 |
16849 |
◊ |
B |
-x,y-1/2,-z+1 |
2_546 |
15 |
7 |
17118 |
140.4 |
-1.2 |
0.404 |
2 |
1 |
0 |
0.000 |
| 9 |
12 |
|
[K]B:1417 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
12 |
7 |
17118 |
119.8 |
-94.4 |
0.000 |
0 |
0 |
0 |
0.522 |
13 |
|
[K]A:1417 |
1 |
1 |
216 |
f |
A |
x,y,z |
1_555 |
13 |
6 |
16849 |
119.6 |
-90.6 |
0.000 |
0 |
0 |
0 |
0.522 |
| Average: |
119.7 |
-92.5 |
0.000 |
0 |
0 |
0 |
0.522 |
| 10 |
14 |
|
[K]B:1418 |
1 |
1 |
216 |
f |
B |
x,y,z |
1_555 |
14 |
7 |
17118 |
103.9 |
-74.4 |
0.000 |
0 |
0 |
0 |
0.210 |
| 11 |
15 |
|
[XE]B:1421 |
1 |
1 |
159 |
f |
B |
x,y,z |
1_555 |
17 |
7 |
17118 |
97.2 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.010 |
16 |
|
[XE]A:1420 |
1 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
19 |
7 |
16849 |
94.2 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.010 |
| Average: |
95.7 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.010 |
| 12 |
17 |
|
[XE]B:1420 |
1 |
1 |
159 |
f |
B |
x,y,z |
1_555 |
16 |
8 |
17118 |
95.8 |
-2.2 |
0.000 |
0 |
0 |
0 |
0.011 |
18 |
|
[XE]A:1419 |
1 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
10 |
6 |
16849 |
88.0 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.011 |
| Average: |
91.9 |
-2.0 |
0.000 |
0 |
0 |
0 |
0.011 |
| 13 |
19 |
|
A |
13 |
6 |
16849 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
12 |
6 |
17118 |
87.2 |
0.0 |
0.621 |
0 |
0 |
0 |
0.000 |
| 14 |
20 |
|
[XE]B:1419 |
1 |
1 |
159 |
f |
B |
x,y,z |
1_555 |
18 |
10 |
17118 |
81.3 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.010 |
21 |
|
[XE]A:1418 |
1 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
16 |
8 |
16849 |
80.5 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.010 |
| Average: |
80.9 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.010 |
| 15 |
22 |
|
[CAM]B:1416 |
6 |
1 |
305 |
f |
[HEM]B:1415 |
x,y,z |
1_555 |
24 |
1 |
834 |
79.4 |
1.3 |
0.164 |
0 |
0 |
0 |
0.000 |
23 |
|
[CAM]A:1416 |
6 |
1 |
306 |
f |
[HEM]A:1415 |
x,y,z |
1_555 |
24 |
1 |
831 |
77.3 |
1.4 |
0.141 |
0 |
0 |
0 |
0.000 |
| Average: |
78.3 |
1.3 |
0.153 |
0 |
0 |
0 |
0.000 |
| 16 |
24 |
|
[XE]A:1421 |
1 |
1 |
159 |
f |
A |
x,y,z |
1_555 |
12 |
7 |
16849 |
68.1 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.008 |
25 |
|
[XE]B:1422 |
1 |
1 |
159 |
f |
B |
x,y,z |
1_555 |
10 |
6 |
17118 |
67.6 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.008 |
| Average: |
67.9 |
-1.5 |
0.000 |
0 |
0 |
0 |
0.008 |
| 17 |
26 |
|
A |
8 |
4 |
16849 |
◊ |
[K]B:1418 |
-x+1,y-1/2,-z |
2_645 |
1 |
1 |
216 |
64.3 |
-33.6 |
0.000 |
0 |
0 |
0 |
0.095 |
| 18 |
27 |
|
[XE]A:1421 |
1 |
1 |
159 |
f |
[XE]A:1418 |
x,y,z |
1_555 |
1 |
1 |
159 |
28.7 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
| 19 |
28 |
|
[XE]B:1422 |
1 |
1 |
159 |
f |
[XE]B:1419 |
x,y,z |
1_555 |
1 |
1 |
159 |
28.2 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.002 |
| 20 |
29 |
|
[XE]A:1421 |
1 |
1 |
159 |
f |
[HEM]A:1415 |
x,y,z |
1_555 |
2 |
1 |
831 |
16.7 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.002 |
30 |
|
[XE]B:1422 |
1 |
1 |
159 |
f |
[HEM]B:1415 |
x,y,z |
1_555 |
2 |
1 |
834 |
14.9 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.002 |
| Average: |
15.8 |
-0.4 |
0.000 |
0 |
0 |
0 |
0.002 |
| 21 |
31 |
|
B |
3 |
2 |
17118 |
◊ |
A |
x,y,z-1 |
1_554 |
5 |
4 |
16849 |
15.6 |
-0.3 |
0.464 |
0 |
0 |
0 |
0.000 |
| 22 |
32 |
|
[K]A:1417 |
1 |
1 |
216 |
◊ |
B |
-x+1,y-1/2,-z+1 |
2_646 |
1 |
1 |
17118 |
14.8 |
-7.5 |
0.000 |
0 |
0 |
0 |
0.000 |
| 23 |
33 |
|
A |
4 |
2 |
16849 |
x |
A |
-x,y-1/2,-z+1 |
2_546 |
2 |
2 |
16849 |
8.5 |
-0.2 |
0.464 |
0 |
0 |
0 |
0.000 |
| 24 |
34 |
|
A |
1 |
1 |
16849 |
◊ |
B |
x,y-1,z |
1_545 |
2 |
2 |
17118 |
5.2 |
0.0 |
0.625 |
0 |
0 |
0 |
0.000 |
|