Finding MtlSFMs for Metals in the PDB entry '3C9U' ... |
PDB Entry | Title | Determination Method | Resolution | R-Factor |
3C9U | AATHIL COMPLEXED WITH ADP AND TPP | X-RAY DIFFRACTION | 1.48 | 0.201
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| 3C9U has 9 MtlSFMs: |
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| Motif No. / Chain | Motif | Bound Ligand /(Nbr. in PDB) | Show Details |
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| 1 / A |
> Structure: LHLS
+1w
> Sequence: DDRD
|
MG /(309) |
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Protein Chain | Prot SSE | Res Nbr | Res Name | RsAt.Name | LgAt.Name |
Lg Chain | Lg Nbr | Bnd Len | Bnd Type |
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A | No SSE | 27 | ASP | CB | MG | A | 309 | 3.65 | | A | No SSE | 27 | ASP | CG | MG | A | 309 | 3.26 | | A | No SSE | 27 | ASP | OD1 | MG | A | 309 | 2.22 | | A | 56-75 H: 1 | 71 | ASP | CG | MG | A | 309 | 3.48 | | A | 56-75 H: 1 | 71 | ASP | OD1 | MG | A | 309 | 2.35 | | A | No SSE | 142 | ARG | NH2 | MG | A | 309 | 3.64 | | A | 204-208 S: 0 | 207 | ASP | CG | MG | A | 309 | 3.21 | | A | 204-208 S: 0 | 207 | ASP | OD1 | MG | A | 309 | 2.13 | | A | 204-208 S: 0 | 207 | ASP | OD2 | MG | A | 309 | 3.65 | | A | Water | 340 | HOH | O | MG | A | 309 | 2.3 | | |
| 2 / A |
> Structure: LSH
+2w
> Sequence: DTD
|
MG /(310) |
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Protein Chain | Prot SSE | Res Nbr | Res Name | RsAt.Name | LgAt.Name |
Lg Chain | Lg Nbr | Bnd Len | Bnd Type |
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A | No SSE | 27 | ASP | C | MG | A | 310 | 3.35 | | A | No SSE | 27 | ASP | O | MG | A | 310 | 2.39 | | A | 36-46 S: -1 | 41 | THR | CB | MG | A | 310 | 3.62 | | A | 36-46 S: -1 | 41 | THR | OG1 | MG | A | 310 | 2.47 | | A | 56-75 H: 1 | 71 | ASP | CG | MG | A | 310 | 3.47 | | A | 56-75 H: 1 | 71 | ASP | OD2 | MG | A | 310 | 2.54 | | A | Water | 323 | HOH | O | MG | A | 310 | 2.64 | | A | Water | 331 | HOH | O | MG | A | 310 | 2.53 | | |
| 3 / A |
> Structure: S
+3w
> Sequence: D
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MG /(311) |
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Protein Chain | Prot SSE | Res Nbr | Res Name | RsAt.Name | LgAt.Name |
Lg Chain | Lg Nbr | Bnd Len | Bnd Type |
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A | 36-46 S: -1 | 43 | ASP | CG | MG | A | 311 | 3.67 | | A | 36-46 S: -1 | 43 | ASP | OD2 | MG | A | 311 | 2.45 | | A | Water | 323 | HOH | O | MG | A | 311 | 2.59 | | A | Water | 334 | HOH | O | MG | A | 311 | 3.9 | | A | Water | 463 | HOH | O | MG | A | 311 | 3.19 | | |
| 4 / A |
> Structure: L
+3w
> Sequence: D
|
MG /(312) |
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Protein Chain | Prot SSE | Res Nbr | Res Name | RsAt.Name | LgAt.Name |
Lg Chain | Lg Nbr | Bnd Len | Bnd Type |
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A | No SSE | 210 | ASP | CG | MG | A | 312 | 2.81 | | A | No SSE | 210 | ASP | OD1 | MG | A | 312 | 2.48 | | A | No SSE | 210 | ASP | OD2 | MG | A | 312 | 2.48 | | A | Water | 332 | HOH | O | MG | A | 312 | 2.48 | | A | Water | 463 | HOH | O | MG | A | 312 | 3.99 | | A | Water | 515 | HOH | O | MG | A | 312 | 2.51 | | |
| 5 / A |
> Structure: SH
+2w
> Sequence: DD
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MG /(313) |
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Protein Chain | Prot SSE | Res Nbr | Res Name | RsAt.Name | LgAt.Name |
Lg Chain | Lg Nbr | Bnd Len | Bnd Type |
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A | 36-46 S: -1 | 43 | ASP | CG | MG | A | 313 | 3.02 | | A | 36-46 S: -1 | 43 | ASP | OD1 | MG | A | 313 | 2.45 | | A | 36-46 S: -1 | 43 | ASP | OD2 | MG | A | 313 | 2.95 | | A | 56-75 H: 1 | 71 | ASP | CG | MG | A | 313 | 2.97 | | A | 56-75 H: 1 | 71 | ASP | OD1 | MG | A | 313 | 2.88 | | A | 56-75 H: 1 | 71 | ASP | OD2 | MG | A | 313 | 2.56 | | A | Water | 319 | HOH | O | MG | A | 313 | 2.46 | | A | Water | 340 | HOH | O | MG | A | 313 | 2.48 | | |
| 6 / A |
> Structure: S
> Sequence: N
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MG /(314) |
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Protein Chain | Prot SSE | Res Nbr | Res Name | RsAt.Name | LgAt.Name |
Lg Chain | Lg Nbr | Bnd Len | Bnd Type |
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A | 114-122 S: 1 | 119 | ASN | CG | MG | A | 314 | 3.47 | | A | 114-122 S: 1 | 119 | ASN | OD1 | MG | A | 314 | 2.26 | | |
| 7 / B |
> Structure: LSH
+2w
> Sequence: DTD
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MG /(309) |
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Protein Chain | Prot SSE | Res Nbr | Res Name | RsAt.Name | LgAt.Name |
Lg Chain | Lg Nbr | Bnd Len | Bnd Type |
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B | No SSE | 27 | ASP | C | MG | B | 309 | 3.38 | | B | No SSE | 27 | ASP | O | MG | B | 309 | 2.37 | | B | 36-46 S: -1 | 41 | THR | CB | MG | B | 309 | 3.64 | | B | 36-46 S: -1 | 41 | THR | OG1 | MG | B | 309 | 2.48 | | B | 56-75 H: 1 | 71 | ASP | CG | MG | B | 309 | 3.46 | | B | 56-75 H: 1 | 71 | ASP | OD2 | MG | B | 309 | 2.51 | | B | Water | 332 | HOH | O | MG | B | 309 | 2.54 | | B | Water | 335 | HOH | O | MG | B | 309 | 2.59 | | |
| 8 / B |
> Structure: L
+3w
> Sequence: D
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MG /(310) |
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Protein Chain | Prot SSE | Res Nbr | Res Name | RsAt.Name | LgAt.Name |
Lg Chain | Lg Nbr | Bnd Len | Bnd Type |
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B | No SSE | 210 | ASP | CG | MG | B | 310 | 2.8 | | B | No SSE | 210 | ASP | OD1 | MG | B | 310 | 2.5 | | B | No SSE | 210 | ASP | OD2 | MG | B | 310 | 2.44 | | B | Water | 407 | HOH | O | MG | B | 310 | 2.63 | | B | Water | 426 | HOH | O | MG | B | 310 | 2.44 | | B | Water | 427 | HOH | O | MG | B | 310 | 2.51 | | |
| 9 / B |
> Structure: SH
+3w
> Sequence: DD
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MG /(311) |
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Protein Chain | Prot SSE | Res Nbr | Res Name | RsAt.Name | LgAt.Name |
Lg Chain | Lg Nbr | Bnd Len | Bnd Type |
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B | 36-46 S: -1 | 43 | ASP | CG | MG | B | 311 | 2.98 | | B | 36-46 S: -1 | 43 | ASP | OD1 | MG | B | 311 | 2.42 | | B | 36-46 S: -1 | 43 | ASP | OD2 | MG | B | 311 | 2.9 | | B | 56-75 H: 1 | 71 | ASP | CG | MG | B | 311 | 2.98 | | B | 56-75 H: 1 | 71 | ASP | OD1 | MG | B | 311 | 2.92 | | B | 56-75 H: 1 | 71 | ASP | OD2 | MG | B | 311 | 2.54 | | B | Water | 316 | HOH | O | MG | B | 311 | 2.46 | | B | Water | 317 | HOH | O | MG | B | 311 | 3.94 | | B | Water | 324 | HOH | O | MG | B | 311 | 2.46 | | |