## |
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 |
269 |
69 |
25249 |
◊ |
A |
x,y,z |
1_555 |
270 |
69 |
25294 |
2517.5 |
-16.6 |
0.453 |
42 |
2 |
0 |
0.808 |
2 |
|
D |
262 |
67 |
25193 |
◊ |
C |
x,y,z |
1_555 |
268 |
68 |
25170 |
2455.7 |
-21.2 |
0.262 |
39 |
2 |
0 |
0.808 |
Average: |
2486.6 |
-18.9 |
0.357 |
41 |
2 |
0 |
0.808 |
2 |
3 |
|
[HEM]B:605 |
42 |
1 |
838 |
f |
B |
x,y,z |
1_555 |
71 |
26 |
25249 |
589.0 |
-20.8 |
0.330 |
4 |
0 |
0 |
0.497 |
3 |
4 |
|
[HEM]D:605 |
43 |
1 |
823 |
f |
D |
x,y,z |
1_555 |
72 |
25 |
25193 |
563.8 |
-18.1 |
0.559 |
4 |
0 |
0 |
0.818 |
5 |
|
[HEM]A:605 |
43 |
1 |
809 |
f |
A |
x,y,z |
1_555 |
69 |
26 |
25294 |
562.3 |
-18.1 |
0.498 |
3 |
0 |
0 |
0.818 |
6 |
|
[HEM]C:605 |
43 |
1 |
797 |
f |
C |
x,y,z |
1_555 |
72 |
25 |
25170 |
558.0 |
-17.7 |
0.531 |
4 |
0 |
0 |
0.818 |
Average: |
561.4 |
-18.0 |
0.530 |
4 |
0 |
0 |
0.818 |
4 |
7 |
|
A |
47 |
14 |
25294 |
◊ |
D |
x,y,z-1 |
1_554 |
49 |
18 |
25193 |
455.6 |
-3.3 |
0.342 |
6 |
0 |
0 |
0.000 |
8 |
|
C |
44 |
13 |
25170 |
◊ |
B |
x,y,z |
1_555 |
44 |
15 |
25249 |
422.4 |
-4.3 |
0.265 |
7 |
0 |
0 |
0.000 |
Average: |
439.0 |
-3.8 |
0.303 |
7 |
0 |
0 |
0.000 |
5 |
9 |
|
[416]C:701 |
21 |
1 |
471 |
f |
C |
x,y,z |
1_555 |
56 |
24 |
25170 |
385.2 |
-1.1 |
0.296 |
4 |
0 |
0 |
0.127 |
10 |
|
[416]A:701 |
21 |
1 |
471 |
f |
A |
x,y,z |
1_555 |
52 |
24 |
25294 |
380.4 |
-1.1 |
0.272 |
4 |
0 |
0 |
0.127 |
11 |
|
[416]D:701 |
21 |
1 |
467 |
f |
D |
x,y,z |
1_555 |
53 |
23 |
25193 |
379.2 |
-1.4 |
0.298 |
4 |
0 |
0 |
0.127 |
12 |
|
[416]B:701 |
21 |
1 |
471 |
f |
B |
x,y,z |
1_555 |
51 |
24 |
25249 |
370.4 |
-0.7 |
0.302 |
4 |
0 |
0 |
0.127 |
Average: |
378.8 |
-1.1 |
0.292 |
4 |
0 |
0 |
0.127 |
6 |
13 |
|
A |
30 |
11 |
25294 |
◊ |
B |
x-1/2,-y-1/2,-z-1 |
4_444 |
28 |
13 |
25249 |
263.3 |
2.0 |
0.865 |
2 |
5 |
0 |
0.000 |
14 |
|
D |
26 |
11 |
25193 |
◊ |
C |
x-1/2,-y-1/2,-z |
4_445 |
27 |
10 |
25170 |
244.9 |
0.8 |
0.735 |
2 |
3 |
0 |
0.000 |
Average: |
254.1 |
1.4 |
0.800 |
2 |
4 |
0 |
0.000 |
7 |
15 |
|
[BOG]A:704 |
19 |
1 |
513 |
◊ |
A |
x,y,z |
1_555 |
34 |
9 |
25294 |
243.8 |
7.2 |
0.406 |
3 |
0 |
0 |
0.000 |
16 |
|
[BOG]C:703 |
18 |
1 |
506 |
◊ |
C |
x,y,z |
1_555 |
32 |
9 |
25170 |
239.5 |
7.2 |
0.433 |
3 |
0 |
0 |
0.000 |
Average: |
241.7 |
7.2 |
0.420 |
3 |
0 |
0 |
0.000 |
8 |
17 |
|
[BOG]A:704 |
16 |
1 |
513 |
f |
B |
x-1/2,-y-1/2,-z-1 |
4_444 |
24 |
7 |
25249 |
214.4 |
3.5 |
0.273 |
1 |
0 |
0 |
0.000 |
18 |
|
D |
25 |
7 |
25193 |
f |
[BOG]C:703 |
x-1/2,-y-1/2,-z |
4_445 |
16 |
1 |
506 |
213.1 |
3.3 |
0.262 |
1 |
0 |
0 |
0.000 |
Average: |
213.8 |
3.4 |
0.268 |
1 |
0 |
0 |
0.000 |
9 |
19 |
|
[NAG]D:681 |
11 |
1 |
364 |
cf |
D |
x,y,z |
1_555 |
26 |
9 |
25193 |
161.5 |
2.7 |
0.372 |
1 |
0 |
0 |
0.000 |
10 |
20 |
|
[NAG]B:681 |
12 |
1 |
361 |
cf |
B |
x,y,z |
1_555 |
26 |
8 |
25249 |
156.3 |
3.0 |
0.365 |
0 |
0 |
0 |
0.000 |
11 |
21 |
|
[NAG]A:671 |
13 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
19 |
7 |
25294 |
141.5 |
3.8 |
0.340 |
1 |
0 |
0 |
0.000 |
22 |
|
[NAG]B:671 |
13 |
1 |
360 |
cf |
B |
x,y,z |
1_555 |
20 |
7 |
25249 |
141.2 |
3.6 |
0.321 |
1 |
0 |
0 |
0.000 |
Average: |
141.3 |
3.7 |
0.330 |
1 |
0 |
0 |
0.000 |
12 |
23 |
|
[NAG]C:671 |
13 |
1 |
362 |
cf |
C |
x,y,z |
1_555 |
19 |
7 |
25170 |
140.6 |
4.2 |
0.352 |
1 |
0 |
0 |
0.000 |
24 |
|
[NAG]D:671 |
12 |
1 |
356 |
cf |
D |
x,y,z |
1_555 |
17 |
7 |
25193 |
136.4 |
3.5 |
0.378 |
1 |
0 |
0 |
0.000 |
Average: |
138.5 |
3.9 |
0.365 |
1 |
0 |
0 |
0.000 |
13 |
25 |
|
[NAG]A:681 |
11 |
1 |
364 |
cf |
A |
x,y,z |
1_555 |
19 |
8 |
25294 |
136.2 |
2.3 |
0.325 |
0 |
0 |
0 |
0.000 |
14 |
26 |
|
[NAG]A:661 |
10 |
1 |
356 |
cf |
A |
x,y,z |
1_555 |
15 |
6 |
25294 |
128.2 |
4.4 |
0.635 |
1 |
0 |
0 |
0.000 |
27 |
|
[NAG]C:661 |
10 |
1 |
356 |
cf |
C |
x,y,z |
1_555 |
15 |
6 |
25170 |
128.1 |
4.5 |
0.583 |
0 |
0 |
0 |
0.000 |
28 |
|
[NAG]B:661 |
9 |
1 |
354 |
cf |
B |
x,y,z |
1_555 |
15 |
5 |
25249 |
122.0 |
4.2 |
0.636 |
1 |
0 |
0 |
0.000 |
Average: |
126.1 |
4.4 |
0.618 |
1 |
0 |
0 |
0.000 |
15 |
29 |
|
[NAG]C:681 |
11 |
1 |
363 |
cf |
C |
x,y,z |
1_555 |
20 |
7 |
25170 |
126.9 |
1.6 |
0.240 |
0 |
0 |
0 |
0.000 |
16 |
30 |
|
[NAG]D:661 |
9 |
1 |
357 |
cf |
D |
x,y,z |
1_555 |
15 |
7 |
25193 |
125.1 |
4.0 |
0.611 |
2 |
0 |
0 |
0.000 |
17 |
31 |
|
B |
9 |
3 |
25249 |
◊ |
A |
-x+1/2,y-1/2,-z-1 |
3_544 |
13 |
4 |
25294 |
88.4 |
-1.4 |
0.327 |
0 |
0 |
0 |
0.000 |
18 |
32 |
|
[NAG]B:672 |
7 |
1 |
360 |
f |
B |
x,y,z |
1_555 |
9 |
3 |
25249 |
82.2 |
2.8 |
0.551 |
0 |
0 |
0 |
0.000 |
33 |
|
[NAG]A:672 |
7 |
1 |
361 |
f |
A |
x,y,z |
1_555 |
10 |
3 |
25294 |
79.9 |
2.7 |
0.539 |
0 |
0 |
0 |
0.000 |
34 |
|
[NAG]D:672 |
6 |
1 |
360 |
f |
D |
x,y,z |
1_555 |
9 |
3 |
25193 |
78.3 |
2.6 |
0.582 |
0 |
0 |
0 |
0.000 |
35 |
|
[NAG]C:672 |
6 |
1 |
355 |
f |
C |
x,y,z |
1_555 |
10 |
3 |
25170 |
72.6 |
2.8 |
0.609 |
0 |
0 |
0 |
0.000 |
Average: |
78.3 |
2.7 |
0.570 |
0 |
0 |
0 |
0.000 |
19 |
36 |
|
[NAG]A:671 |
8 |
1 |
364 |
◊ |
B |
x,y,z |
1_555 |
9 |
3 |
25249 |
76.1 |
0.8 |
0.194 |
0 |
0 |
0 |
0.000 |
20 |
37 |
|
D |
9 |
3 |
25193 |
x |
D |
-x+1/2,y-1/2,-z |
3_545 |
7 |
3 |
25193 |
75.1 |
0.5 |
0.775 |
1 |
1 |
0 |
0.000 |
21 |
38 |
|
[NAG]C:673 |
7 |
1 |
358 |
cf |
[NAG]C:672 |
x,y,z |
1_555 |
8 |
1 |
355 |
73.5 |
2.4 |
0.143 |
0 |
0 |
0 |
0.000 |
39 |
|
[NAG]D:673 |
6 |
1 |
358 |
cf |
[NAG]D:672 |
x,y,z |
1_555 |
7 |
1 |
360 |
67.2 |
2.2 |
0.165 |
0 |
0 |
0 |
0.000 |
Average: |
70.3 |
2.3 |
0.154 |
0 |
0 |
0 |
0.000 |
22 |
40 |
|
[NAG]C:672 |
9 |
1 |
355 |
cf |
[NAG]C:671 |
x,y,z |
1_555 |
6 |
1 |
362 |
73.2 |
1.7 |
0.102 |
1 |
0 |
0 |
0.000 |
41 |
|
[NAG]D:672 |
10 |
1 |
360 |
cf |
[NAG]D:671 |
x,y,z |
1_555 |
6 |
1 |
356 |
70.1 |
1.6 |
0.084 |
0 |
0 |
0 |
0.000 |
Average: |
71.6 |
1.7 |
0.093 |
1 |
0 |
0 |
0.000 |
23 |
42 |
|
[NAG]B:671 |
7 |
1 |
360 |
◊ |
A |
x,y,z |
1_555 |
8 |
3 |
25294 |
71.7 |
0.6 |
0.200 |
1 |
0 |
0 |
0.006 |
43 |
|
[NAG]D:671 |
8 |
1 |
356 |
◊ |
C |
x,y,z |
1_555 |
7 |
2 |
25170 |
66.1 |
0.2 |
0.118 |
1 |
0 |
0 |
0.006 |
Average: |
68.9 |
0.4 |
0.159 |
1 |
0 |
0 |
0.006 |
24 |
44 |
|
[NAG]B:673 |
7 |
1 |
356 |
cf |
[NAG]B:672 |
x,y,z |
1_555 |
9 |
1 |
360 |
71.0 |
2.0 |
0.103 |
0 |
0 |
0 |
0.000 |
25 |
45 |
|
[NAG]B:672 |
9 |
1 |
360 |
cf |
[NAG]B:671 |
x,y,z |
1_555 |
6 |
1 |
360 |
70.7 |
1.8 |
0.102 |
0 |
0 |
0 |
0.000 |
46 |
|
[NAG]A:672 |
9 |
1 |
361 |
cf |
[NAG]A:671 |
x,y,z |
1_555 |
6 |
1 |
364 |
67.8 |
1.4 |
0.096 |
0 |
0 |
0 |
0.000 |
Average: |
69.2 |
1.6 |
0.099 |
0 |
0 |
0 |
0.000 |
26 |
47 |
|
[NAG]C:671 |
10 |
1 |
362 |
◊ |
D |
x,y,z |
1_555 |
8 |
3 |
25193 |
63.7 |
0.2 |
0.118 |
0 |
0 |
0 |
0.000 |
27 |
48 |
|
C |
7 |
4 |
25170 |
◊ |
D |
-x+1/2,y-1/2,-z |
3_545 |
8 |
4 |
25193 |
62.6 |
0.5 |
0.691 |
1 |
1 |
0 |
0.000 |
28 |
49 |
|
[NAG]A:673 |
8 |
1 |
353 |
cf |
[NAG]A:672 |
x,y,z |
1_555 |
6 |
1 |
361 |
59.7 |
1.6 |
0.105 |
0 |
0 |
0 |
0.000 |
29 |
50 |
|
[NAG]D:672 |
5 |
1 |
360 |
◊ |
C |
x,y,z |
1_555 |
8 |
3 |
25170 |
55.5 |
0.8 |
0.339 |
1 |
0 |
0 |
0.000 |
51 |
|
[NAG]C:672 |
5 |
1 |
355 |
◊ |
D |
x,y,z |
1_555 |
7 |
2 |
25193 |
54.4 |
0.8 |
0.304 |
0 |
0 |
0 |
0.000 |
52 |
|
[NAG]A:672 |
5 |
1 |
361 |
◊ |
B |
x,y,z |
1_555 |
10 |
3 |
25249 |
54.3 |
0.9 |
0.375 |
1 |
0 |
0 |
0.000 |
53 |
|
[NAG]B:672 |
5 |
1 |
360 |
◊ |
A |
x,y,z |
1_555 |
7 |
2 |
25294 |
53.3 |
0.7 |
0.304 |
0 |
0 |
0 |
0.000 |
Average: |
54.4 |
0.8 |
0.331 |
1 |
0 |
0 |
0.000 |
30 |
54 |
|
[NAG]C:673 |
5 |
1 |
358 |
◊ |
D |
x,y,z |
1_555 |
1 |
1 |
25193 |
9.2 |
0.4 |
0.292 |
0 |
0 |
0 |
0.000 |
55 |
|
[NAG]D:673 |
1 |
1 |
358 |
◊ |
C |
x,y,z |
1_555 |
1 |
1 |
25170 |
3.4 |
0.2 |
0.479 |
0 |
0 |
0 |
0.000 |
Average: |
6.3 |
0.3 |
0.386 |
0 |
0 |
0 |
0.000 |
31 |
56 |
|
[NAG]A:673 |
2 |
1 |
353 |
◊ |
B |
x,y,z |
1_555 |
3 |
2 |
25249 |
5.5 |
0.4 |
0.404 |
0 |
0 |
0 |
0.000 |
32 |
57 |
|
[NAG]D:673 |
1 |
1 |
358 |
f |
D |
x,y,z |
1_555 |
2 |
1 |
25193 |
3.8 |
0.2 |
0.471 |
0 |
0 |
0 |
0.000 |
58 |
|
[NAG]C:673 |
1 |
1 |
358 |
f |
C |
x,y,z |
1_555 |
1 |
1 |
25170 |
2.5 |
0.2 |
0.346 |
0 |
0 |
0 |
0.000 |
Average: |
3.2 |
0.2 |
0.408 |
0 |
0 |
0 |
0.000 |
|