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MolNFT v1 · #117583 · protein

Crystal structure of monobody MB(S4) bound to PRDM14 in complex with MTGR1

5ECJ · Pr domain zinc finger protein 14,PROTEIN CBFA2T2: “Crystal structure of monobody MB(S4) bound to PRDM14 in complex with MTGR1”. X-ray diffraction, 11 pockets (best druggability 0.65). MolNFT v1 #117583 on GenesisL1: 3D structure…

PDB
5ECJ
Type
protein
Length
712 residues
Chains
4
Method
x-ray diffraction
Collection
MolNFT v1 / PDB
Contract
0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner
0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule
Pr domain zinc finger protein 14,PROTEIN CBFA2T2; Monobody MB(S4)
EC
2.1.1.-
UniProt
E9Q3T6, O70374
Pockets
11 · best druggability 0.65

Structure

x-ray diffraction · 3 distinct chains · 26% helix, 32% strand (DSSP).

ChainMoleculeTypeResiduesSecondary structureUniProt
APr domain zinc finger protein 14,PROTEIN CBFA2T2 (EC 2.1.1.-)protein26330% helix, 26% strandE9Q3T6, O70374
F, EMonobody MB(S4)protein930% helix, 61% strand—
BPr domain zinc finger protein 14,PROTEIN CBFA2T2 (EC 2.1.1.-)protein26331% helix, 27% strandE9Q3T6, O70374

Pockets

11 pockets found on a 1 Å grid, 6 with a druggability of 0.5 or more.

PocketVolume (ų)DruggabilityBuriednessLining residuesInside
16540.650.7552empty
2780.630.9022empty
31250.570.8431empty
43150.570.7636empty
5530.530.8820empty

Interfaces

3 interfaces between chains.

  • A–B · 882 Ų buried · 9 hydrogen bonds · protein-protein
  • A–E · 597 Ų buried · 7 hydrogen bonds · protein-protein
  • F–B · 582 Ų buried · 8 hydrogen bonds · protein-protein

Compared structures

  • 5ECJ · Crystal structure of monobody Mb(S4) bound to Prdm14 in complex with Mtgr1 · the same entry in another collection · chain E against E, TM-score 1.00
  • E9Q3T6 · AlphaFold monomer V2.0 prediction for pr domain zinc finger protein 14 (E9Q3T6) · a predicted model of the same protein · chain A against A, TM-score 0.64
  • O70374 · AlphaFold monomer V2.0 prediction for protein CBFA2T2 (O70374) · a predicted model of the same protein · chain A against A, TM-score 0.34

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