## |
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 |
|
[HEM]B:501 |
42 |
1 |
832 |
f |
B |
x,y,z |
1_555 |
81 |
33 |
18538 |
582.8 |
-22.4 |
0.350 |
7 |
0 |
0 |
0.541 |
2 |
|
[HEM]D:501 |
43 |
1 |
821 |
f |
D |
x,y,z |
1_555 |
88 |
34 |
18773 |
573.3 |
-22.3 |
0.405 |
7 |
0 |
0 |
0.541 |
3 |
|
[HEM]E:501 |
43 |
1 |
829 |
f |
E |
x,y,z |
1_555 |
91 |
35 |
18655 |
573.1 |
-21.9 |
0.416 |
6 |
0 |
0 |
0.541 |
4 |
|
[HEM]F:501 |
43 |
1 |
811 |
f |
F |
x,y,z |
1_555 |
79 |
35 |
18294 |
570.1 |
-22.0 |
0.276 |
5 |
0 |
0 |
0.541 |
5 |
|
[HEM]A:501 |
43 |
1 |
825 |
f |
A |
x,y,z |
1_555 |
80 |
35 |
18438 |
569.9 |
-22.1 |
0.354 |
7 |
0 |
0 |
0.541 |
6 |
|
[HEM]C:501 |
43 |
1 |
814 |
f |
C |
x,y,z |
1_555 |
82 |
34 |
18524 |
566.2 |
-22.5 |
0.279 |
8 |
0 |
0 |
0.541 |
Average: |
572.6 |
-22.2 |
0.347 |
7 |
0 |
0 |
0.541 |
2 |
7 |
|
E |
58 |
17 |
18655 |
◊ |
A |
x,y,z |
1_555 |
55 |
12 |
18438 |
523.4 |
-3.9 |
0.559 |
3 |
2 |
0 |
0.000 |
8 |
|
D |
43 |
15 |
18773 |
◊ |
C |
x,y,z |
1_555 |
40 |
12 |
18524 |
363.6 |
-3.5 |
0.485 |
1 |
0 |
0 |
0.000 |
9 |
|
C |
43 |
15 |
18524 |
◊ |
B |
x-1,y,z |
1_455 |
41 |
11 |
18538 |
362.2 |
-2.0 |
0.642 |
4 |
3 |
0 |
0.000 |
10 |
|
F |
41 |
11 |
18294 |
◊ |
A |
x,y-1,z |
1_545 |
48 |
16 |
18438 |
360.6 |
-2.8 |
0.576 |
2 |
2 |
0 |
0.000 |
Average: |
402.4 |
-3.0 |
0.566 |
3 |
2 |
0 |
0.000 |
3 |
11 |
|
B |
54 |
13 |
18538 |
◊ |
D |
x,y-1,z |
1_545 |
53 |
17 |
18773 |
493.2 |
-6.7 |
0.283 |
2 |
1 |
0 |
0.186 |
12 |
|
C |
54 |
16 |
18524 |
◊ |
D |
x,y-1,z |
1_545 |
45 |
11 |
18773 |
463.7 |
-8.5 |
0.112 |
1 |
0 |
0 |
0.186 |
13 |
|
E |
51 |
13 |
18655 |
◊ |
A |
x-1,y,z |
1_455 |
53 |
16 |
18438 |
462.5 |
-8.9 |
0.114 |
3 |
0 |
0 |
0.186 |
14 |
|
E |
48 |
15 |
18655 |
◊ |
F |
x-1,y,z |
1_455 |
53 |
12 |
18294 |
437.7 |
-7.1 |
0.217 |
1 |
0 |
0 |
0.186 |
15 |
|
C |
44 |
11 |
18524 |
◊ |
B |
x,y,z |
1_555 |
51 |
17 |
18538 |
432.7 |
-7.3 |
0.182 |
1 |
0 |
0 |
0.186 |
16 |
|
F |
43 |
13 |
18294 |
◊ |
A |
x,y,z |
1_555 |
42 |
11 |
18438 |
395.0 |
-7.9 |
0.111 |
1 |
0 |
0 |
0.186 |
Average: |
447.5 |
-7.7 |
0.170 |
2 |
0 |
0 |
0.186 |
4 |
17 |
|
[QKM]E:502 |
29 |
1 |
641 |
f |
E |
x,y,z |
1_555 |
62 |
23 |
18655 |
440.3 |
-4.5 |
0.166 |
2 |
0 |
0 |
0.108 |
18 |
|
[QKM]B:502 |
29 |
1 |
642 |
f |
B |
x,y,z |
1_555 |
58 |
24 |
18538 |
439.4 |
-4.8 |
0.147 |
0 |
0 |
0 |
0.108 |
19 |
|
[QKM]D:502 |
29 |
1 |
642 |
f |
D |
x,y,z |
1_555 |
51 |
24 |
18773 |
436.3 |
-4.6 |
0.109 |
0 |
0 |
0 |
0.108 |
20 |
|
[QKM]F:502 |
29 |
1 |
645 |
f |
F |
x,y,z |
1_555 |
61 |
23 |
18294 |
436.0 |
-4.6 |
0.142 |
0 |
0 |
0 |
0.108 |
21 |
|
[QKM]A:502 |
29 |
1 |
644 |
f |
A |
x,y,z |
1_555 |
58 |
22 |
18438 |
434.2 |
-4.7 |
0.136 |
1 |
0 |
0 |
0.108 |
22 |
|
[QKM]C:502 |
29 |
1 |
638 |
f |
C |
x,y,z |
1_555 |
55 |
22 |
18524 |
427.3 |
-4.9 |
0.096 |
1 |
0 |
0 |
0.108 |
Average: |
435.6 |
-4.7 |
0.132 |
1 |
0 |
0 |
0.108 |
5 |
23 |
|
F |
32 |
10 |
18294 |
◊ |
D |
x,y-1,z |
1_545 |
28 |
10 |
18773 |
250.5 |
-1.2 |
0.622 |
1 |
1 |
0 |
0.000 |
6 |
24 |
|
B |
30 |
9 |
18538 |
◊ |
A |
x,y,z |
1_555 |
18 |
8 |
18438 |
229.0 |
-3.8 |
0.177 |
1 |
1 |
0 |
0.000 |
7 |
25 |
|
F |
22 |
6 |
18294 |
◊ |
C |
x,y,z-1 |
1_554 |
22 |
6 |
18524 |
176.4 |
-1.7 |
0.502 |
2 |
0 |
0 |
0.000 |
26 |
|
E |
17 |
6 |
18655 |
◊ |
D |
x-1,y-1,z-1 |
1_444 |
16 |
5 |
18773 |
132.7 |
-1.7 |
0.439 |
0 |
0 |
0 |
0.000 |
27 |
|
A |
12 |
4 |
18438 |
◊ |
B |
x,y,z-1 |
1_554 |
11 |
3 |
18538 |
94.8 |
-1.4 |
0.413 |
1 |
0 |
0 |
0.000 |
Average: |
134.6 |
-1.6 |
0.451 |
1 |
0 |
0 |
0.000 |
8 |
28 |
|
[QKM]C:502 |
11 |
1 |
638 |
f |
[HEM]C:501 |
x,y,z |
1_555 |
33 |
1 |
814 |
131.4 |
-3.9 |
0.444 |
1 |
0 |
0 |
0.081 |
29 |
|
[QKM]A:502 |
11 |
1 |
644 |
f |
[HEM]A:501 |
x,y,z |
1_555 |
30 |
1 |
825 |
129.7 |
-3.7 |
0.445 |
0 |
0 |
0 |
0.081 |
30 |
|
[QKM]D:502 |
11 |
1 |
642 |
f |
[HEM]D:501 |
x,y,z |
1_555 |
34 |
1 |
821 |
126.7 |
-3.5 |
0.453 |
0 |
0 |
0 |
0.081 |
31 |
|
[QKM]B:502 |
12 |
1 |
642 |
f |
[HEM]B:501 |
x,y,z |
1_555 |
30 |
1 |
832 |
126.4 |
-3.7 |
0.450 |
0 |
0 |
0 |
0.081 |
32 |
|
[QKM]F:502 |
12 |
1 |
645 |
cf |
[HEM]F:501 |
x,y,z |
1_555 |
31 |
1 |
811 |
125.7 |
-3.2 |
0.462 |
0 |
0 |
0 |
0.081 |
33 |
|
[QKM]E:502 |
12 |
1 |
641 |
f |
[HEM]E:501 |
x,y,z |
1_555 |
31 |
1 |
829 |
124.5 |
-3.6 |
0.453 |
0 |
0 |
0 |
0.081 |
Average: |
127.4 |
-3.6 |
0.451 |
0 |
0 |
0 |
0.081 |
9 |
34 |
|
F |
6 |
5 |
18294 |
◊ |
B |
x,y,z |
1_555 |
8 |
3 |
18538 |
88.4 |
-2.6 |
0.073 |
0 |
0 |
0 |
0.000 |
10 |
35 |
|
[FE]F:503 |
1 |
1 |
137 |
◊ |
F |
x,y,z |
1_555 |
8 |
3 |
18294 |
43.1 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.103 |
36 |
|
[FE]B:503 |
1 |
1 |
137 |
◊ |
C |
x,y,z |
1_555 |
9 |
3 |
18524 |
42.4 |
-5.0 |
0.000 |
0 |
0 |
0 |
0.103 |
37 |
|
[FE]B:503 |
1 |
1 |
137 |
◊ |
B |
x,y,z |
1_555 |
7 |
3 |
18538 |
41.9 |
-5.2 |
0.000 |
0 |
0 |
0 |
0.103 |
38 |
|
E |
9 |
3 |
18655 |
◊ |
[FE]F:503 |
x-1,y,z |
1_455 |
1 |
1 |
137 |
39.7 |
-4.7 |
0.000 |
0 |
0 |
0 |
0.103 |
39 |
|
[FE]F:503 |
1 |
1 |
137 |
◊ |
A |
x,y,z |
1_555 |
12 |
3 |
18438 |
38.5 |
-4.5 |
0.000 |
0 |
0 |
0 |
0.103 |
40 |
|
[FE]B:503 |
1 |
1 |
137 |
◊ |
D |
x,y-1,z |
1_545 |
6 |
2 |
18773 |
38.0 |
-4.4 |
0.000 |
0 |
0 |
0 |
0.103 |
Average: |
40.6 |
-4.8 |
0.000 |
0 |
0 |
0 |
0.103 |
11 |
41 |
|
E |
4 |
3 |
18655 |
◊ |
D |
x,y,z-1 |
1_554 |
3 |
1 |
18773 |
28.5 |
0.1 |
0.601 |
0 |
0 |
0 |
0.000 |
12 |
42 |
|
F |
3 |
1 |
18294 |
◊ |
E |
x,y-1,z |
1_545 |
2 |
1 |
18655 |
24.7 |
-0.8 |
0.199 |
0 |
0 |
0 |
0.000 |
43 |
|
D |
1 |
1 |
18773 |
◊ |
B |
x-1,y,z |
1_455 |
3 |
1 |
18538 |
21.7 |
-0.7 |
0.169 |
0 |
0 |
0 |
0.000 |
Average: |
23.2 |
-0.7 |
0.184 |
0 |
0 |
0 |
0.000 |
13 |
44 |
|
E |
2 |
2 |
18655 |
◊ |
B |
x-1,y,z |
1_455 |
2 |
2 |
18538 |
16.0 |
0.1 |
0.492 |
0 |
0 |
0 |
0.000 |
|