BMRB: 4365

Dynamics of Stromelysin/Inhibitor Interactions Studied by 15N NMR Relaxation Measurements: Comparison of Ligand Binding to the S1-S3 and S1-S3 Subsites

Authors

Yuan, P., Marshall, V.P., Petzold, G.L., Poorman, R.A., Stockman, B.J.

Assembly

stromelysin-ligand complexes

Entity

1. stromelysin (polymer, Thiol state: not present), 166 monomers, 18572.38 Da Detail

PKWRKTHLTY RIVNYPPDLP KDAVDSAVEK ALKVWEEVTP LTFSRLYEGE ADIMISFAVR EHGDFYPFDG PGNVLAHAYA PGPGINGDAH FDDDEQWTKD TTGTNLFLVA AHEIGHSLGL FHSANTEALM YPLYHSLTDL TRFRLSQDDI NGIQSLYGPP PDSPET

2. 6-CHLORO-2-(1-FURO[2,3-C]PYRIDIN-5-YL-ETHYLSULFANYL)-PYRIMIDIN-4-YLAMINE (non-polymer), 306.771 Da

Total weight

18879.152 Da

Max. entity weight

18572.38 Da

Source organism

Homo sapiens

Exptl. method

NMR

Data set

heteronucl_NOEs, heteronucl_T1_relaxation, heteronucl_T2_relaxation, order_parameters

Heteronucl. T₁

141 T₁ values in 1 lists
Coherence Sz, Field strength (¹H) 600 MHz, Temperature 300 K, pH 6.5 Detail

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Temperature 300 K, pH 6.5

Heteronucl. T₂

141 T₂ values in 1 lists
Coherence S(+,-), Field strength (¹H) 600 MHz, Temperature 300 K, pH 6.5 Detail

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Temperature 300 K, pH 6.5

Heteronucl. NOE

141 NOE values in 1 lists
Value type relative intensities, Field strength (¹H) 600 MHz, Temperature 300 K, pH 6.5 Detail

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Temperature 300 K, pH 6.5

Heteronucl. T₁/T₂

141 T₁/T₂ values in 1 lists
Field strength (¹H) 600 MHz, Temperature 300 K, pH 6.5 Detail

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Temperature 300 K, pH 6.5

Order parameters

141 S² values in 1 lists
Temperature 300 K, pH 6.5 Detail

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Temperature 300 K, pH 6.5

List #1 S2_parameters_label

Release date

2007-07-12

Citation

Dynamics of stromelysin/inhibitor interactions studied by 15N NMR relaxation measurements: comparison of ligand binding to the S1-S3 and S'1-S'3 subsites
Yuan, P., Marshall, V.P., Petzold, G.L., Poorman, R.A., Stockman, B.J.
J. Biomol. NMR (1999), 15, 55-64, PubMed 10549133 , Abstract

Related entities 1. stromelysin, : 1 : 44 : 233 entities Detail

Interaction partners 1. stromelysin, : 2 interactors Detail

Experiments performed 4 experiments Detail