Raw JSON data
{
"mxlims_type": "ReflectionSet",
"version": "0.2.2",
"uuid": "ce4fe23500520899e362b0171d75abf1",
"space_group_name": "P 21 21 21",
"unit_cell": {
"a": 35.775,
"b": 90.816,
"c": 131.927,
"alpha": 90.0,
"beta": 90.0,
"gamma": 90.0
},
"wavelengths": [0.91162,0.97871,0.97808],
"anisotropic_diffraction": false,
"overall_refln_statistics": {
"resolution_limits": [45.408,1.90],
"number_observations_unique": 34769,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.075
},
{
"type": "I/SigI",
"value": 11.440
},
{
"type": "Completeness",
"value": 99.600
},
{
"type": "Redundancy",
"value": 4.00
}
]
},
"refln_shells": [
{
"resolution_limits": [1.97,1.90],
"number_observations": 13887,
"number_observations_unique": 3498,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.723
},
{
"type": "I/SigI",
"value": 2.0
},
{
"type": "Completeness",
"value": 99.70
}
]
},
{
"resolution_limits": [2.05,1.97],
"number_observations": 13801,
"number_observations_unique": 3433,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.516
},
{
"type": "I/SigI",
"value": 2.9
},
{
"type": "Completeness",
"value": 99.80
}
]
},
{
"resolution_limits": [2.14,2.05],
"number_observations": 13350,
"number_observations_unique": 3309,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.375
},
{
"type": "I/SigI",
"value": 3.9
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [2.25,2.14],
"number_observations": 13602,
"number_observations_unique": 3358,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.286
},
{
"type": "I/SigI",
"value": 5.1
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [2.39,2.25],
"number_observations": 14014,
"number_observations_unique": 3462,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.206
},
{
"type": "I/SigI",
"value": 6.8
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [2.58,2.39],
"number_observations": 14342,
"number_observations_unique": 3551,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.161
},
{
"type": "I/SigI",
"value": 8.4
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [2.84,2.58],
"number_observations": 13893,
"number_observations_unique": 3445,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.111
},
{
"type": "I/SigI",
"value": 11.4
},
{
"type": "Completeness",
"value": 100.00
}
]
},
{
"resolution_limits": [3.25,2.84],
"number_observations": 14153,
"number_observations_unique": 3523,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.068
},
{
"type": "I/SigI",
"value": 16.6
},
{
"type": "Completeness",
"value": 99.90
}
]
},
{
"resolution_limits": [4.08,3.25],
"number_observations": 13788,
"number_observations_unique": 3471,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.038
},
{
"type": "I/SigI",
"value": 25.0
},
{
"type": "Completeness",
"value": 99.70
}
]
},
{
"resolution_limits": [45.408,4.08],
"number_observations": 14193,
"number_observations_unique": 3698,
"quality_factors": [
{
"type": "R(merge)",
"value": 0.031
},
{
"type": "I/SigI",
"value": 30.3
},
{
"type": "Completeness",
"value": 97.60
}
]
}
]
}