MolNFT v1 · #97019 · protein

Structure of pim-1 kinase bound to 5-(4-cyanobenzyl)-N-(4- fluorophenyl)-7-HYDROXYPYRAZOLO[1,5-A]PYRIMIDINE-3-carboxamide

4K18 · SERINE/THREONINE-protein kinase pim-1: “Structure of pim-1 kinase bound to 5-(4-cyanobenzyl)-N-(4…”. X-ray diffraction, 2 ligands (1OB, PO4), 2 pockets (best druggability 0.66). MolNFT v1 #97019 on GenesisL1: 3D structure, binding…

PDB: 4K18
Type: protein
Length: 277 residues
Chains: 1
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: SERINE/THREONINE-protein kinase pim-1
EC: 2.7.11.1
UniProt: P11309
Ligands: 1OB, PO4
Pockets: 2 · best druggability 0.66

Structure

x-ray diffraction · 1 distinct chain · 40% helix, 23% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A	SERINE/THREONINE-protein kinase pim-1 (EC 2.7.11.1)	protein	277	40% helix, 23% strand	P11309

Ligands and binding sites

1OB · 5-(4-cyanobenzyl)-N-(4-fluorophenyl)-7-hydroxypyrazolo[1,5-a]pyrimidine-3-carboxamide · ligand · chains A
PO4 · Phosphate ion · ion · chains A

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

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

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	263	0.66	0.82	28	1OB
2	124	0.47	0.79	28	empty

Compared structures

4K18 · Structure of PIM-1 kinase bound to 5-(4-cyanobenzyl)-N-(4-fluorophenyl)-7-hydroxypyrazolo[… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt P11309
Elsewhere: RCSB PDB 4K18 · PDBe 4K18 · UniProt P11309

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