## |
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 |
81 |
28 |
6169 |
◊ |
A |
x,y,z |
1_555 |
76 |
23 |
6285 |
774.3 |
-17.5 |
0.010 |
3 |
0 |
0 |
0.231 |
2 |
|
D |
76 |
24 |
6389 |
◊ |
C |
x,y,z |
1_555 |
77 |
22 |
5933 |
731.3 |
-15.6 |
0.022 |
3 |
0 |
0 |
0.231 |
Average: |
752.8 |
-16.6 |
0.016 |
3 |
0 |
0 |
0.231 |
2 |
3 |
|
[HEM]B:1259 |
43 |
1 |
813 |
f |
B |
x,y,z |
1_555 |
89 |
28 |
6169 |
605.1 |
-21.3 |
0.441 |
4 |
0 |
0 |
0.649 |
4 |
|
[HEM]C:1259 |
43 |
1 |
809 |
f |
C |
x,y,z |
1_555 |
82 |
27 |
5933 |
603.4 |
-21.4 |
0.463 |
6 |
0 |
0 |
0.649 |
5 |
|
[HEM]A:1258 |
43 |
1 |
810 |
f |
A |
x,y,z |
1_555 |
83 |
26 |
6285 |
602.2 |
-21.2 |
0.449 |
4 |
0 |
0 |
0.649 |
6 |
|
[HEM]D:1259 |
43 |
1 |
814 |
f |
D |
x,y,z |
1_555 |
84 |
26 |
6389 |
599.8 |
-21.3 |
0.394 |
5 |
0 |
0 |
0.649 |
Average: |
602.7 |
-21.3 |
0.437 |
5 |
0 |
0 |
0.649 |
3 |
7 |
|
D |
39 |
10 |
6389 |
◊ |
B |
x,y,z |
1_555 |
37 |
12 |
6169 |
377.0 |
-4.1 |
0.310 |
4 |
0 |
0 |
0.000 |
4 |
8 |
|
D |
35 |
8 |
6389 |
◊ |
C |
x-1,y,z |
1_455 |
40 |
11 |
5933 |
345.5 |
0.9 |
0.786 |
6 |
5 |
0 |
0.000 |
5 |
9 |
|
A |
31 |
9 |
6285 |
◊ |
B |
x,y-1,z |
1_545 |
33 |
10 |
6169 |
308.9 |
0.4 |
0.712 |
4 |
2 |
0 |
0.000 |
6 |
10 |
|
D |
34 |
11 |
6389 |
◊ |
B |
x-1,y+1,z |
1_465 |
28 |
7 |
6169 |
288.1 |
-1.8 |
0.485 |
2 |
0 |
0 |
0.000 |
7 |
11 |
|
A |
28 |
8 |
6285 |
◊ |
C |
x,y-1,z+1 |
1_546 |
27 |
9 |
5933 |
262.0 |
-2.4 |
0.453 |
0 |
0 |
0 |
0.021 |
8 |
12 |
|
A |
28 |
7 |
6285 |
◊ |
C |
x,y-1,z |
1_545 |
27 |
8 |
5933 |
253.1 |
-4.4 |
0.206 |
0 |
0 |
0 |
0.051 |
9 |
13 |
|
D |
31 |
10 |
6389 |
◊ |
A |
x-1,y+1,z |
1_465 |
26 |
9 |
6285 |
248.5 |
-0.7 |
0.584 |
2 |
2 |
0 |
0.000 |
10 |
14 |
|
D |
14 |
4 |
6389 |
◊ |
B |
x-1,y,z |
1_455 |
12 |
4 |
6169 |
127.6 |
-1.6 |
0.316 |
0 |
0 |
0 |
0.000 |
11 |
15 |
|
C |
7 |
4 |
5933 |
◊ |
B |
x,y,z |
1_555 |
10 |
5 |
6169 |
86.1 |
-0.5 |
0.490 |
0 |
0 |
0 |
0.000 |
12 |
16 |
|
C |
7 |
3 |
5933 |
◊ |
B |
x-1,y+1,z |
1_465 |
8 |
2 |
6169 |
71.5 |
0.4 |
0.533 |
1 |
0 |
0 |
0.000 |
13 |
17 |
|
B |
8 |
3 |
6169 |
◊ |
C |
x,y-1,z+1 |
1_546 |
8 |
2 |
5933 |
64.5 |
-0.2 |
0.576 |
0 |
0 |
0 |
0.003 |
18 |
|
A |
7 |
2 |
6285 |
◊ |
D |
x,y-1,z+1 |
1_546 |
8 |
3 |
6389 |
52.3 |
-0.3 |
0.536 |
0 |
0 |
0 |
0.003 |
Average: |
58.4 |
-0.3 |
0.556 |
0 |
0 |
0 |
0.003 |
14 |
19 |
|
D |
7 |
2 |
6389 |
◊ |
A |
x,y,z |
1_555 |
6 |
2 |
6285 |
60.0 |
0.5 |
0.514 |
0 |
0 |
0 |
0.000 |
15 |
20 |
|
[CL]A:1259 |
1 |
1 |
125 |
f |
A |
x,y,z |
1_555 |
14 |
5 |
6285 |
51.7 |
-7.1 |
0.000 |
0 |
0 |
0 |
0.147 |
21 |
|
[CL]C:1261 |
1 |
1 |
125 |
f |
C |
x,y,z |
1_555 |
15 |
7 |
5933 |
43.4 |
-5.6 |
0.000 |
0 |
0 |
0 |
0.147 |
Average: |
47.5 |
-6.4 |
0.000 |
0 |
0 |
0 |
0.147 |
16 |
22 |
|
A |
9 |
5 |
6285 |
◊ |
[NA]C:1260 |
x,y-1,z |
1_545 |
1 |
1 |
125 |
48.2 |
-6.2 |
0.000 |
0 |
0 |
0 |
0.139 |
23 |
|
[NA]C:1260 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
11 |
5 |
5933 |
47.6 |
-5.8 |
0.000 |
0 |
0 |
0 |
0.139 |
Average: |
47.9 |
-6.0 |
0.000 |
0 |
0 |
0 |
0.139 |
17 |
24 |
|
[CL]A:1259 |
1 |
1 |
125 |
◊ |
B |
x,y,z |
1_555 |
8 |
4 |
6169 |
37.4 |
-3.9 |
0.000 |
0 |
0 |
0 |
0.046 |
25 |
|
[CL]C:1261 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
9 |
4 |
6389 |
31.3 |
-3.2 |
0.000 |
0 |
0 |
0 |
0.046 |
Average: |
34.4 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.046 |
18 |
26 |
|
A |
9 |
4 |
6285 |
f |
[CL]C:1262 |
x,y-1,z+1 |
1_546 |
1 |
1 |
125 |
35.0 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.047 |
19 |
27 |
|
A |
9 |
5 |
6285 |
◊ |
[CL]C:1264 |
x,y-1,z+1 |
1_546 |
1 |
1 |
125 |
33.4 |
-4.0 |
0.000 |
0 |
0 |
0 |
0.066 |
28 |
|
[CL]C:1264 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
9 |
5 |
5933 |
30.5 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.066 |
Average: |
31.9 |
-3.8 |
0.000 |
0 |
0 |
0 |
0.066 |
20 |
29 |
|
A |
6 |
4 |
6285 |
◊ |
[NA]C:1263 |
x,y-1,z+1 |
1_546 |
1 |
1 |
125 |
32.8 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.058 |
30 |
|
[NA]C:1263 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
6 |
4 |
5933 |
32.1 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.058 |
Average: |
32.5 |
-3.3 |
0.000 |
0 |
0 |
0 |
0.058 |
21 |
31 |
|
[NA]C:1265 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
9 |
5 |
5933 |
28.8 |
-2.6 |
0.000 |
0 |
0 |
0 |
0.023 |
22 |
32 |
|
[CL]C:1262 |
1 |
1 |
125 |
◊ |
C |
x,y,z |
1_555 |
5 |
2 |
5933 |
28.2 |
-2.7 |
0.000 |
0 |
0 |
0 |
0.023 |
23 |
33 |
|
A |
11 |
5 |
6285 |
f |
[NA]C:1265 |
x,y-1,z+1 |
1_546 |
1 |
1 |
125 |
25.8 |
-2.5 |
0.000 |
0 |
0 |
0 |
0.030 |
24 |
34 |
|
[NA]C:1263 |
1 |
1 |
125 |
f |
[CL]C:1264 |
x,y,z |
1_555 |
1 |
1 |
125 |
20.4 |
-4.1 |
0.000 |
0 |
0 |
0 |
0.100 |
25 |
35 |
|
[CL]C:1262 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
2 |
1 |
6389 |
18.5 |
-1.9 |
0.000 |
0 |
0 |
0 |
0.009 |
26 |
36 |
|
[NA]C:1265 |
1 |
1 |
125 |
f |
[CL]C:1262 |
x,y,z |
1_555 |
1 |
1 |
125 |
17.3 |
-3.5 |
0.000 |
0 |
0 |
0 |
0.040 |
27 |
37 |
|
[NA]C:1265 |
1 |
1 |
125 |
◊ |
[CL]C:1261 |
x,y,z |
1_555 |
1 |
1 |
125 |
16.8 |
-3.4 |
0.000 |
0 |
0 |
0 |
0.030 |
28 |
38 |
|
[NA]C:1265 |
1 |
1 |
125 |
◊ |
[NA]C:1263 |
x,y,z |
1_555 |
1 |
1 |
125 |
15.5 |
-3.1 |
0.000 |
0 |
0 |
0 |
0.027 |
29 |
39 |
|
[NA]C:1265 |
1 |
1 |
125 |
◊ |
D |
x,y,z |
1_555 |
4 |
2 |
6389 |
15.4 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.006 |
30 |
40 |
|
B |
5 |
3 |
6169 |
◊ |
[HEM]C:1259 |
x,y-1,z+1 |
1_546 |
1 |
1 |
809 |
15.0 |
-0.9 |
0.376 |
0 |
0 |
0 |
0.007 |
41 |
|
[HEM]A:1258 |
1 |
1 |
810 |
◊ |
D |
x,y-1,z+1 |
1_546 |
2 |
1 |
6389 |
9.0 |
-0.6 |
0.378 |
0 |
0 |
0 |
0.007 |
Average: |
12.0 |
-0.7 |
0.377 |
0 |
0 |
0 |
0.007 |
31 |
42 |
|
[NA]C:1265 |
1 |
1 |
125 |
◊ |
[CL]C:1264 |
x,y,z |
1_555 |
1 |
1 |
125 |
14.0 |
-2.8 |
0.000 |
0 |
0 |
0 |
0.024 |
32 |
43 |
|
[CL]C:1264 |
1 |
1 |
125 |
◊ |
[CL]C:1262 |
x,y,z |
1_555 |
1 |
1 |
125 |
9.0 |
-1.8 |
0.000 |
0 |
0 |
0 |
0.016 |
33 |
44 |
|
[CL]C:1262 |
1 |
1 |
125 |
◊ |
[CL]C:1261 |
x,y,z |
1_555 |
1 |
1 |
125 |
8.5 |
-1.7 |
0.000 |
0 |
0 |
0 |
0.015 |
34 |
45 |
|
[NA]C:1263 |
1 |
1 |
125 |
◊ |
[CL]C:1261 |
x,y,z |
1_555 |
1 |
1 |
125 |
6.8 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.012 |
35 |
46 |
|
[CL]A:1259 |
1 |
1 |
125 |
◊ |
[NA]C:1263 |
x,y-1,z+1 |
1_546 |
1 |
1 |
125 |
6.8 |
-1.4 |
0.000 |
0 |
0 |
0 |
0.012 |
36 |
47 |
|
[CL]A:1259 |
1 |
1 |
125 |
◊ |
[CL]C:1264 |
x,y-1,z+1 |
1_546 |
1 |
1 |
125 |
6.0 |
-1.2 |
0.000 |
0 |
0 |
0 |
0.011 |
37 |
48 |
|
[HEM]D:1259 |
1 |
1 |
814 |
◊ |
B |
x-1,y+1,z |
1_465 |
1 |
1 |
6169 |
5.6 |
-0.2 |
0.589 |
0 |
0 |
0 |
0.000 |
38 |
49 |
|
[NA]C:1263 |
1 |
1 |
125 |
◊ |
[CL]C:1262 |
x,y,z |
1_555 |
1 |
1 |
125 |
4.9 |
-1.0 |
0.000 |
0 |
0 |
0 |
0.009 |
39 |
50 |
|
[CL]C:1264 |
1 |
1 |
125 |
◊ |
[CL]C:1261 |
x,y,z |
1_555 |
1 |
1 |
125 |
3.1 |
-0.6 |
0.000 |
0 |
0 |
0 |
0.005 |
40 |
51 |
|
A |
1 |
1 |
6285 |
◊ |
D |
x,y-1,z |
1_545 |
1 |
1 |
6389 |
1.0 |
-0.0 |
0.557 |
0 |
0 |
0 |
0.000 |
|